IGMH analysis implemented according to Multiwfn Software Manual (Section 4.20.11)
http://sobereva.com/multiwfn/misc/Multiwfn%20quick%20start.pdf
 
 
 ----------------   CP     1,     Type (3,-3)   ----------------
 Corresponding nucleus:    96(H )
 Position (Bohr):       -5.047862485467  -13.073318855878    0.181019805825
 Position (Angstrom):   -2.671213791081   -6.918102409399    0.095791555965
 Density of all electrons:  0.4401079671E+00
 Density of Alpha electrons:  0.2200539836E+00
 Density of Beta electrons:  0.2200539836E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6833018186E-02
 G(r) in X,Y,Z:  0.1808444315E-02  0.2365244670E-02  0.2659329201E-02
 Hamiltonian kinetic energy K(r):  0.6616879905E+01
 Potential energy density V(r): -0.6623712923E+01
 Energy density E(r) or H(r): -0.6616879905E+01
 Laplacian of electron density: -0.2644018755E+02
 Electron localization function (ELF):  0.9999124097E+00
 Localized orbital locator (LOL):  0.9907408312E+00
 Local information entropy:  0.6506244929E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4401079671E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2979834831E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5539312501E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1501259953E+00
 Wavefunction value for orbital         1 : -0.4323043358E-06
 Average local ionization energy (ALIE):  0.5095307584E+00
 Delta-g (under promolecular approximation):  0.1111669592E+00
 Delta-g (under Hirshfeld partition):  0.1942827911E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7341544715E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2231610473E-14 -0.2919324040E-14 -0.1708730152E-16
 Norm of gradient is:  0.3674619726E-14
 
 Components of Laplacian in x/y/z are:
 -0.8609995647E+01 -0.8875169793E+01 -0.8955022105E+01
 Total: -0.2644018755E+02
 
 Hessian matrix:
 -0.8609995647E+01  0.2672266708E+00 -0.1909592266E+00
  0.2672266708E+00 -0.8875169793E+01 -0.1192914454E+00
 -0.1909592266E+00 -0.1192914454E+00 -0.8955022105E+01
 Eigenvalues of Hessian: -0.9041292669E+01 -0.9039706277E+01 -0.8359188599E+01
 Eigenvectors(columns) of Hessian:
  0.3056119859E+00  0.5243442616E+00 -0.7947731811E+00
 -0.8285306706E+00 -0.2648685047E+00 -0.4933372104E+00
 -0.4691889193E+00  0.8092637213E+00  0.3534883129E+00
 Determinant of Hessian: -0.6832017513E+03
 Ellipticity of electron density:    0.000175
 eta index:   -1.081599
 
 ----------------   CP     2,     Type (3,-3)   ----------------
 Corresponding nucleus:    94(H )
 Position (Bohr):       -1.755257874109  -13.065011110156    0.085298773210
 Position (Angstrom):   -0.928842466236   -6.913706139689    0.045138166901
 Density of all electrons:  0.4401144996E+00
 Density of Alpha electrons:  0.2200572498E+00
 Density of Beta electrons:  0.2200572498E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6855606392E-02
 G(r) in X,Y,Z:  0.1794568274E-02  0.2365176047E-02  0.2695862071E-02
 Hamiltonian kinetic energy K(r):  0.6619440441E+01
 Potential energy density V(r): -0.6626296047E+01
 Energy density E(r) or H(r): -0.6619440441E+01
 Laplacian of electron density: -0.2645033934E+02
 Electron localization function (ELF):  0.9999118349E+00
 Localized orbital locator (LOL):  0.9907107348E+00
 Local information entropy:  0.6506327660E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4401144996E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2979687786E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1876580456E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1596680742E+00
 Wavefunction value for orbital         1 :  0.3095895538E-05
 Average local ionization energy (ALIE):  0.5085564070E+00
 Delta-g (under promolecular approximation):  0.1105279056E+00
 Delta-g (under Hirshfeld partition):  0.1929059744E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7452351028E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3367867585E-15  0.3364734621E-14 -0.1091721906E-16
 Norm of gradient is:  0.3381565256E-14
 
 Components of Laplacian in x/y/z are:
 -0.8591917642E+01 -0.8880104059E+01 -0.8978317636E+01
 Total: -0.2645033934E+02
 
 Hessian matrix:
 -0.8591917642E+01 -0.2697030179E+00  0.1682861337E+00
 -0.2697030179E+00 -0.8880104059E+01 -0.1018829499E+00
  0.1682861337E+00 -0.1018829499E+00 -0.8978317636E+01
 Eigenvalues of Hessian: -0.9042520943E+01 -0.9040887658E+01 -0.8366930736E+01
 Eigenvectors(columns) of Hessian:
 -0.2076223904E+00 -0.5390902329E+00 -0.8162564939E+00
 -0.7435188831E+00 -0.4552728511E+00  0.4898023086E+00
 -0.6356670618E+00  0.7085960428E+00 -0.3062989303E+00
 Determinant of Hessian: -0.6840168021E+03
 Ellipticity of electron density:    0.000181
 eta index:   -1.080745
 
 ----------------   CP     3,     Type (3,-3)   ----------------
 Corresponding nucleus:    77(C )
 Position (Bohr):       -3.425737047065  -12.080430830676   -0.545745183282
 Position (Angstrom):   -1.812821975853   -6.392688693484   -0.288795913953
 Density of all electrons:  0.1219947676E+03
 Density of Alpha electrons:  0.6099738379E+02
 Density of Beta electrons:  0.6099738379E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8779124391E+01
 G(r) in X,Y,Z:  0.2982378006E+01  0.2837346242E+01  0.2959400143E+01
 Hamiltonian kinetic energy K(r):  0.2418554694E+06
 Potential energy density V(r): -0.2418642485E+06
 Energy density E(r) or H(r): -0.2418554694E+06
 Laplacian of electron density: -0.9673867612E+06
 Electron localization function (ELF):  0.9999989618E+00
 Localized orbital locator (LOL):  0.9989821003E+00
 Local information entropy:  0.3497013175E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1219947676E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213947669E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6883469967E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6124949681E+04
 Wavefunction value for orbital         1 :  0.2380547144E-05
 Average local ionization energy (ALIE):  0.1018741412E+02
 Delta-g (under promolecular approximation):  0.3864229513E-01
 Delta-g (under Hirshfeld partition):  0.5158872628E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1008773339E+08
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3325762883E-10 -0.2406522433E-09  0.1117690807E-10
 Norm of gradient is:  0.2431964132E-09
 
 Components of Laplacian in x/y/z are:
 -0.3224620355E+06 -0.3224626042E+06 -0.3224621215E+06
 Total: -0.9673867612E+06
 
 Hessian matrix:
 -0.3224620355E+06  0.2260014394E-01 -0.9290361467E-02
  0.2260014394E-01 -0.3224626042E+06 -0.2018900672E+00
 -0.9290361467E-02 -0.2018900672E+00 -0.3224621215E+06
 Eigenvalues of Hessian: -0.3224626780E+06 -0.3224620593E+06 -0.3224620239E+06
 Eigenvectors(columns) of Hessian:
  0.2813663875E-01  0.5605283294E+00  0.8276571280E+00
 -0.9398402758E+00 -0.2671676936E+00  0.2128888900E+00
 -0.3404534998E+00  0.7838554812E+00 -0.5192898988E+00
 Determinant of Hessian: -0.3353023946E+17
 Ellipticity of electron density:    0.000002
 eta index:   -1.000002
 
 ----------------   CP     4,     Type (3,-3)   ----------------
 Corresponding nucleus:    53(H )
 Position (Bohr):      -12.036069762920   -8.906191644493    6.625747799003
 Position (Angstrom):   -6.369213827376   -4.712953654201    3.506194740423
 Density of all electrons:  0.4400325052E+00
 Density of Alpha electrons:  0.2200162526E+00
 Density of Beta electrons:  0.2200162526E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6215229368E-02
 G(r) in X,Y,Z:  0.2100525734E-02  0.1761932919E-02  0.2352770715E-02
 Hamiltonian kinetic energy K(r):  0.6591624061E+01
 Potential energy density V(r): -0.6597839290E+01
 Energy density E(r) or H(r): -0.6591624061E+01
 Laplacian of electron density: -0.2634163533E+02
 Electron localization function (ELF):  0.9999274686E+00
 Localized orbital locator (LOL):  0.9915685285E+00
 Local information entropy:  0.6505289216E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4400325052E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2977431126E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2640070001E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1280248799E+00
 Wavefunction value for orbital         1 : -0.1802133353E-05
 Average local ionization energy (ALIE):  0.5395921133E+00
 Delta-g (under promolecular approximation):  0.1139726284E+00
 Delta-g (under Hirshfeld partition):  0.2026278778E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6829025817E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4603545635E-14 -0.7012858833E-14  0.2776476910E-14
 Norm of gradient is:  0.8836381921E-14
 
 Components of Laplacian in x/y/z are:
 -0.8952244095E+01 -0.8598666460E+01 -0.8790724771E+01
 Total: -0.2634163533E+02
 
 Hessian matrix:
 -0.8952244095E+01  0.1879503865E+00 -0.1389720254E+00
  0.1879503865E+00 -0.8598666460E+01 -0.3190805203E+00
 -0.1389720254E+00 -0.3190805203E+00 -0.8790724771E+01
 Eigenvalues of Hessian: -0.9033598566E+01 -0.9027857805E+01 -0.8280178955E+01
 Eigenvectors(columns) of Hessian:
  0.9399366323E+00  0.9275988260E-01 -0.3285037768E+00
 -0.3209899664E+00  0.5675761208E+00 -0.7581706856E+00
  0.1161230755E+00  0.8180788172E+00  0.5632605792E+00
 Determinant of Hessian: -0.6752820732E+03
 Ellipticity of electron density:    0.000636
 eta index:   -1.090991
 
 ----------------   CP     5,     Type (3,-3)   ----------------
 Corresponding nucleus:    95(H )
 Position (Bohr):       -3.484866801589  -12.191649935229   -2.580967925445
 Position (Angstrom):   -1.844112094433   -6.451543309030   -1.365789408217
 Density of all electrons:  0.4402190585E+00
 Density of Alpha electrons:  0.2201095292E+00
 Density of Beta electrons:  0.2201095292E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6851839162E-02
 G(r) in X,Y,Z:  0.2897151967E-02  0.2691693388E-02  0.1262993807E-02
 Hamiltonian kinetic energy K(r):  0.6625024285E+01
 Potential energy density V(r): -0.6631876124E+01
 Energy density E(r) or H(r): -0.6625024285E+01
 Laplacian of electron density: -0.2647268978E+02
 Electron localization function (ELF):  0.9999120013E+00
 Localized orbital locator (LOL):  0.9907194328E+00
 Local information entropy:  0.6507651832E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4402190585E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2979970835E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.9468833909E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1628005916E+00
 Wavefunction value for orbital         1 : -0.3069687808E-06
 Average local ionization energy (ALIE):  0.5082878302E+00
 Delta-g (under promolecular approximation):  0.1105623308E+00
 Delta-g (under Hirshfeld partition):  0.1929596600E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7562645130E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3208575760E-15 -0.7976787025E-14 -0.8736171898E-15
 Norm of gradient is:  0.8030895829E-14
 
 Components of Laplacian in x/y/z are:
 -0.9048026981E+01 -0.9047311210E+01 -0.8377351592E+01
 Total: -0.2647268978E+02
 
 Hessian matrix:
 -0.9048026981E+01  0.1615104588E-02  0.2015313383E-01
  0.1615104588E-02 -0.9047311210E+01  0.4162549330E-01
  0.2015313383E-01  0.4162549330E-01 -0.8377351592E+01
 Eigenvalues of Hessian: -0.9049986995E+01 -0.9048533929E+01 -0.8374168859E+01
 Eigenvectors(columns) of Hessian:
  0.2614886872E+00 -0.9647406870E+00  0.2998455114E-01
 -0.9638150013E+00 -0.2593181450E+00  0.6176360478E-01
  0.5181032433E-01  0.4505004413E-01  0.9976403078E+00
 Determinant of Hessian: -0.6857532715E+03
 Ellipticity of electron density:    0.000161
 eta index:   -1.080703
 
 ----------------   CP     6,     Type (3,-3)   ----------------
 Corresponding nucleus:    49(H )
 Position (Bohr):       -7.478543995812   -8.418927059954    5.788014889562
 Position (Angstrom):   -3.957475053319   -4.455104340382    3.062885575924
 Density of all electrons:  0.4398347335E+00
 Density of Alpha electrons:  0.2199173668E+00
 Density of Beta electrons:  0.2199173668E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6205374796E-02
 G(r) in X,Y,Z:  0.1712051650E-02  0.1935402801E-02  0.2557920345E-02
 Hamiltonian kinetic energy K(r):  0.6592244039E+01
 Potential energy density V(r): -0.6598449414E+01
 Energy density E(r) or H(r): -0.6592244039E+01
 Laplacian of electron density: -0.2634415466E+02
 Electron localization function (ELF):  0.9999275896E+00
 Localized orbital locator (LOL):  0.9915755280E+00
 Local information entropy:  0.6502784342E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4398347335E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2977545345E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3611043836E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1655757425E+00
 Wavefunction value for orbital         1 : -0.1514860306E-05
 Average local ionization energy (ALIE):  0.5406341455E+00
 Delta-g (under promolecular approximation):  0.1140060677E+00
 Delta-g (under Hirshfeld partition):  0.2025995231E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7403277630E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3630040719E-14  0.6940610628E-14 -0.1567312179E-14
 Norm of gradient is:  0.7987849459E-14
 
 Components of Laplacian in x/y/z are:
 -0.8711388707E+01 -0.8712079554E+01 -0.8920686395E+01
 Total: -0.2634415466E+02
 
 Hessian matrix:
 -0.8711388707E+01 -0.3215023457E+00  0.1889391983E+00
 -0.3215023457E+00 -0.8712079554E+01 -0.1851841616E+00
  0.1889391983E+00 -0.1851841616E+00 -0.8920686395E+01
 Eigenvalues of Hessian: -0.9034464221E+01 -0.9028839726E+01 -0.8280850709E+01
 Eigenvectors(columns) of Hessian:
  0.7504381943E+00  0.9056418196E-01  0.6547065338E+00
  0.5002677384E+00  0.5695330721E+00 -0.6521995627E+00
 -0.4319429434E+00  0.8169640192E+00  0.3820930318E+00
 Determinant of Hessian: -0.6754750329E+03
 Ellipticity of electron density:    0.000623
 eta index:   -1.091007
 
 ----------------   CP     7,     Type (3,-3)   ----------------
 Corresponding nucleus:    93(H )
 Position (Bohr):       -3.415647191665   -9.260048924652    2.374031770437
 Position (Angstrom):   -1.807482654314   -4.900206862773    1.256283510875
 Density of all electrons:  0.4443371257E+00
 Density of Alpha electrons:  0.2221685628E+00
 Density of Beta electrons:  0.2221685628E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6819648055E-02
 G(r) in X,Y,Z:  0.2754997722E-02  0.2700439830E-02  0.1364210502E-02
 Hamiltonian kinetic energy K(r):  0.6698835053E+01
 Potential energy density V(r): -0.6705654701E+01
 Energy density E(r) or H(r): -0.6698835053E+01
 Laplacian of electron density: -0.2676806162E+02
 Electron localization function (ELF):  0.9999154888E+00
 Localized orbital locator (LOL):  0.9909035814E+00
 Local information entropy:  0.6559762823E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4443371257E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2983294860E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3611328149E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2098362796E+00
 Wavefunction value for orbital         1 :  0.8301486392E-05
 Average local ionization energy (ALIE):  0.5100136946E+00
 Delta-g (under promolecular approximation):  0.1109401611E+00
 Delta-g (under Hirshfeld partition):  0.1954058416E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8187446655E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5133201772E-15 -0.3673578663E-14  0.4779168255E-16
 Norm of gradient is:  0.3709577044E-14
 
 Components of Laplacian in x/y/z are:
 -0.9150565164E+01 -0.9149664870E+01 -0.8467831586E+01
 Total: -0.2676806162E+02
 
 Hessian matrix:
 -0.9150565164E+01 -0.1514794087E-03 -0.5927906100E-02
 -0.1514794087E-03 -0.9149664870E+01  0.2728343399E-01
 -0.5927906100E-02  0.2728343399E-01 -0.8467831586E+01
 Eigenvalues of Hessian: -0.9150795508E+01 -0.9150575931E+01 -0.8466690180E+01
 Eigenvectors(columns) of Hessian:
  0.4301909358E+00 -0.9026962915E+00 -0.8669720892E-02
 -0.9018618194E+00 -0.4301766262E+00  0.3991652556E-01
  0.3976201088E-01  0.9352837227E-02  0.9991654052E+00
 Determinant of Hessian: -0.7089587182E+03
 Ellipticity of electron density:    0.000024
 eta index:   -1.080800
 
 ----------------   CP     8,     Type (3,-3)   ----------------
 Corresponding nucleus:    25(C )
 Position (Bohr):      -11.373554753715   -7.376785845290    5.489397338281
 Position (Angstrom):   -6.018625982624   -3.903626959039    2.904863973010
 Density of all electrons:  0.1221826566E+03
 Density of Alpha electrons:  0.6109132832E+02
 Density of Beta electrons:  0.6109132832E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8723059991E+01
 G(r) in X,Y,Z:  0.3224907717E+01  0.2902453995E+01  0.2595698279E+01
 Hamiltonian kinetic energy K(r):  0.2422541620E+06
 Potential energy density V(r): -0.2422628850E+06
 Energy density E(r) or H(r): -0.2422541620E+06
 Laplacian of electron density: -0.9689817556E+06
 Electron localization function (ELF):  0.9999989802E+00
 Localized orbital locator (LOL):  0.9989911824E+00
 Local information entropy:  0.3498415301E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221826566E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213979135E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1279463203E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5272201728E+04
 Wavefunction value for orbital         1 : -0.2580705434E-05
 Average local ionization energy (ALIE):  0.1019701261E+02
 Delta-g (under promolecular approximation):  0.4796704683E-01
 Delta-g (under Hirshfeld partition):  0.6287076999E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5883841592E+08
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1016945959E-09  0.5446450504E-11 -0.1026040330E-09
 Norm of gradient is:  0.1445650105E-09
 
 Components of Laplacian in x/y/z are:
 -0.3229928567E+06 -0.3229939392E+06 -0.3229949598E+06
 Total: -0.9689817556E+06
 
 Hessian matrix:
 -0.3229928567E+06 -0.2084115330E+00 -0.1841818070E+00
 -0.2084115330E+00 -0.3229939392E+06 -0.1369670782E+01
 -0.1841818070E+00 -0.1369670782E+01 -0.3229949598E+06
 Eigenvalues of Hessian: -0.3229959349E+06 -0.3229930120E+06 -0.3229928087E+06
 Eigenvectors(columns) of Hessian:
  0.8747321189E-01  0.3436068302E+00  0.9350308997E+00
  0.5698977340E+00  0.7525931830E+00 -0.3298788772E+00
  0.8170465164E+00 -0.5617275559E+00  0.1299890110E+00
 Determinant of Hessian: -0.3369636362E+17
 Ellipticity of electron density:    0.000009
 eta index:   -1.000010
 
 ----------------   CP     9,     Type (3,-3)   ----------------
 Corresponding nucleus:    76(C )
 Position (Bohr):       -3.417190983309   -9.338501402422    0.337292994471
 Position (Angstrom):   -1.808299593670   -4.941722126148    0.178487766071
 Density of all electrons:  0.1220126641E+03
 Density of Alpha electrons:  0.6100633204E+02
 Density of Beta electrons:  0.6100633204E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8729594603E+01
 G(r) in X,Y,Z:  0.2884451458E+01  0.2865428964E+01  0.2979714181E+01
 Hamiltonian kinetic energy K(r):  0.2419011554E+06
 Potential energy density V(r): -0.2419098850E+06
 Energy density E(r) or H(r): -0.2419011554E+06
 Laplacian of electron density: -0.9675697034E+06
 Electron localization function (ELF):  0.9999989740E+00
 Localized orbital locator (LOL):  0.9989880844E+00
 Local information entropy:  0.3497146992E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1220126641E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213949830E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1587077240E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7738520514E+04
 Wavefunction value for orbital         1 :  0.6976861105E-05
 Average local ionization energy (ALIE):  0.1019757138E+02
 Delta-g (under promolecular approximation):  0.3847115499E-01
 Delta-g (under Hirshfeld partition):  0.5109262360E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6526875964E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.5278165117E-10 -0.1863561321E-09 -0.7668817919E-11
 Norm of gradient is:  0.1938383900E-09
 
 Components of Laplacian in x/y/z are:
 -0.3225233332E+06 -0.3225234011E+06 -0.3225229691E+06
 Total: -0.9675697034E+06
 
 Hessian matrix:
 -0.3225233332E+06 -0.3036249294E+00  0.2473981963E+00
 -0.3036249294E+00 -0.3225234011E+06 -0.3608995416E-01
  0.2473981963E+00 -0.3608995416E-01 -0.3225229691E+06
 Eigenvalues of Hessian: -0.3225237014E+06 -0.3225232136E+06 -0.3225227885E+06
 Eigenvectors(columns) of Hessian:
 -0.7005782995E+00 -0.4768833789E+00  0.5308222765E+00
 -0.6841001399E+00  0.6604511327E+00 -0.3095340044E+00
  0.2029705519E+00  0.5799884000E+00  0.7889337177E+00
 Determinant of Hessian: -0.3354926574E+17
 Ellipticity of electron density:    0.000002
 eta index:   -1.000003
 
 ----------------   CP    10,     Type (3,-3)   ----------------
 Corresponding nucleus:    20(C )
 Position (Bohr):       -8.799243217040   -7.103761928852    5.016217439128
 Position (Angstrom):   -4.656358983650   -3.759148924429    2.654467953721
 Density of all electrons:  0.1221848387E+03
 Density of Alpha electrons:  0.6109241933E+02
 Density of Beta electrons:  0.6109241933E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8727660900E+01
 G(r) in X,Y,Z:  0.3216615331E+01  0.2907327692E+01  0.2603717877E+01
 Hamiltonian kinetic energy K(r):  0.2422602444E+06
 Potential energy density V(r): -0.2422689720E+06
 Energy density E(r) or H(r): -0.2422602444E+06
 Laplacian of electron density: -0.9690060668E+06
 Electron localization function (ELF):  0.9999989792E+00
 Localized orbital locator (LOL):  0.9989906808E+00
 Local information entropy:  0.3498431549E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221848387E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213979157E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3612588947E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6232988767E+04
 Wavefunction value for orbital         1 :  0.4159705447E-06
 Average local ionization energy (ALIE):  0.1019836081E+02
 Delta-g (under promolecular approximation):  0.4615713558E-01
 Delta-g (under Hirshfeld partition):  0.6130586075E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.3507226916E+08
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1507993364E-09  0.1364694508E-09 -0.8905936881E-11
 Norm of gradient is:  0.2035771760E-09
 
 Components of Laplacian in x/y/z are:
 -0.3230009954E+06 -0.3230020311E+06 -0.3230030403E+06
 Total: -0.9690060668E+06
 
 Hessian matrix:
 -0.3230009954E+06 -0.8952535583E-01 -0.2665354574E+00
 -0.8952535583E-01 -0.3230020311E+06 -0.1381369756E+01
 -0.2665354574E+00 -0.1381369756E+01 -0.3230030403E+06
 Eigenvalues of Hessian: -0.3230040303E+06 -0.3230011101E+06 -0.3230009264E+06
 Eigenvectors(columns) of Hessian:
  0.8858794351E-01 -0.4932113296E+00  0.8653870583E+00
  0.5689092239E+00  0.7382039412E+00  0.3624875669E+00
  0.8176151119E+00 -0.4602146516E+00 -0.3459884438E+00
 Determinant of Hessian: -0.3369889995E+17
 Ellipticity of electron density:    0.000009
 eta index:   -1.000010
 
 ----------------   CP    11,     Type (3,-3)   ----------------
 Corresponding nucleus:    46(H )
 Position (Bohr):        9.607685317178  -10.425369836081   -0.088277666838
 Position (Angstrom):    5.084168119378   -5.516868132489   -0.046714529522
 Density of all electrons:  0.4388929511E+00
 Density of Alpha electrons:  0.2194464755E+00
 Density of Beta electrons:  0.2194464755E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6083731459E-02
 G(r) in X,Y,Z:  0.2131013725E-02  0.1048741821E-02  0.2903975914E-02
 Hamiltonian kinetic energy K(r):  0.6570775091E+01
 Potential energy density V(r): -0.6576858823E+01
 Energy density E(r) or H(r): -0.6570775091E+01
 Laplacian of electron density: -0.2625876544E+02
 Electron localization function (ELF):  0.9999298969E+00
 Localized orbital locator (LOL):  0.9917099886E+00
 Local information entropy:  0.6490853621E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4388929511E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2976604143E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2423613766E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1473880808E+00
 Wavefunction value for orbital         1 :  0.6035355752E-06
 Average local ionization energy (ALIE):  0.5457385947E+00
 Delta-g (under promolecular approximation):  0.1143042401E+00
 Delta-g (under Hirshfeld partition):  0.2033166327E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7087102294E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5522268569E-14 -0.1904840726E-14 -0.3042542347E-16
 Norm of gradient is:  0.5841643095E-14
 
 Components of Laplacian in x/y/z are:
 -0.8964782758E+01 -0.8293279879E+01 -0.9000702801E+01
 Total: -0.2625876544E+02
 
 Hessian matrix:
 -0.8964782758E+01 -0.1779030477E+00  0.1210257338E-01
 -0.1779030477E+00 -0.8293279879E+01 -0.4640124150E-01
  0.1210257338E-01 -0.4640124150E-01 -0.9000702801E+01
 Eigenvalues of Hessian: -0.9009060224E+01 -0.9003692245E+01 -0.8246012970E+01
 Eigenvectors(columns) of Hessian:
  0.9668559043E+00  0.8493082176E-01  0.2407829226E+00
  0.2336300722E+00  0.8610503337E-01 -0.9685055047E+00
 -0.1029885900E+00  0.9926593971E+00  0.6340876588E-01
 Determinant of Hessian: -0.6688737396E+03
 Ellipticity of electron density:    0.000596
 eta index:   -1.092535
 
 ----------------   CP    12,     Type (3,-3)   ----------------
 Corresponding nucleus:    52(H )
 Position (Bohr):      -15.056391530908   -5.849708793313    4.838302135709
 Position (Angstrom):   -7.967499276589   -3.095532583840    2.560319229681
 Density of all electrons:  0.4398362281E+00
 Density of Alpha electrons:  0.2199181141E+00
 Density of Beta electrons:  0.2199181141E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6190477259E-02
 G(r) in X,Y,Z:  0.1045658093E-02  0.2455069639E-02  0.2689749528E-02
 Hamiltonian kinetic energy K(r):  0.6588115410E+01
 Potential energy density V(r): -0.6594305887E+01
 Energy density E(r) or H(r): -0.6588115410E+01
 Laplacian of electron density: -0.2632769973E+02
 Electron localization function (ELF):  0.9999279371E+00
 Localized orbital locator (LOL):  0.9915956302E+00
 Local information entropy:  0.6502803272E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4398362281E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2977364633E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1694269336E-08
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1242501476E+00
 Wavefunction value for orbital         1 : -0.2953119974E-05
 Average local ionization energy (ALIE):  0.5403516669E+00
 Delta-g (under promolecular approximation):  0.1140252743E+00
 Delta-g (under Hirshfeld partition):  0.2027257042E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6795358524E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1907611248E-14  0.1259175378E-14  0.9199836797E-15
 Norm of gradient is:  0.2463914219E-14
 
 Components of Laplacian in x/y/z are:
 -0.8305947906E+01 -0.9020045274E+01 -0.9001706551E+01
 Total: -0.2632769973E+02
 
 Hessian matrix:
 -0.8305947906E+01  0.7416162563E-01 -0.1309620030E+00
  0.7416162563E-01 -0.9020045274E+01 -0.1078589923E-01
 -0.1309620030E+00 -0.1078589923E-01 -0.9001706551E+01
 Eigenvalues of Hessian: -0.9029396568E+01 -0.9023714199E+01 -0.8274588965E+01
 Eigenvectors(columns) of Hessian:
  0.1823390701E+00 -0.9143859178E-01  0.9789746919E+00
 -0.8196120514E+00 -0.5641302300E+00  0.9996583802E-01
  0.5431284827E+00 -0.8206071335E+00 -0.1778071533E+00
 Determinant of Hessian: -0.6742027024E+03
 Ellipticity of electron density:    0.000630
 eta index:   -1.091220
 
 ----------------   CP    13,     Type (3,-3)   ----------------
 Corresponding nucleus:    92(H )
 Position (Bohr):       -5.108260320881   -8.396209238454   -0.289584480467
 Position (Angstrom):   -2.703174949170   -4.443082586963   -0.153241507695
 Density of all electrons:  0.4451101531E+00
 Density of Alpha electrons:  0.2225550765E+00
 Density of Beta electrons:  0.2225550765E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6911641579E-02
 G(r) in X,Y,Z:  0.1814516786E-02  0.2400900903E-02  0.2696223890E-02
 Hamiltonian kinetic energy K(r):  0.6722371038E+01
 Potential energy density V(r): -0.6729282680E+01
 Energy density E(r) or H(r): -0.6722371038E+01
 Laplacian of electron density: -0.2686183759E+02
 Electron localization function (ELF):  0.9999136985E+00
 Localized orbital locator (LOL):  0.9908084276E+00
 Local information entropy:  0.6569535857E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4451101531E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2984883021E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2307583674E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2174051662E+00
 Wavefunction value for orbital         1 :  0.1482036563E-05
 Average local ionization energy (ALIE):  0.5093215874E+00
 Delta-g (under promolecular approximation):  0.1117380064E+00
 Delta-g (under Hirshfeld partition):  0.1972357939E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8400145665E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1296861441E-15 -0.6617300905E-15 -0.2173829591E-15
 Norm of gradient is:  0.7084917498E-15
 
 Components of Laplacian in x/y/z are:
 -0.8703110856E+01 -0.9036382008E+01 -0.9122344722E+01
 Total: -0.2686183759E+02
 
 Hessian matrix:
 -0.8703110856E+01 -0.2681152777E+00  0.1738608800E+00
 -0.2681152777E+00 -0.9036382008E+01 -0.9665081095E-01
  0.1738608800E+00 -0.9665081095E-01 -0.9122344722E+01
 Eigenvalues of Hessian: -0.9185425424E+01 -0.9185054381E+01 -0.8491357781E+01
 Eigenvectors(columns) of Hessian:
  0.4842260255E+00 -0.2658061235E+00  0.8335899837E+00
  0.8749228519E+00  0.1406468711E+00 -0.4633880242E+00
  0.5929551354E-02  0.9537114670E+00  0.3006647270E+00
 Determinant of Hessian: -0.7164042401E+03
 Ellipticity of electron density:    0.000040
 eta index:   -1.081738
 
 ----------------   CP    14,     Type (3,-3)   ----------------
 Corresponding nucleus:    90(H )
 Position (Bohr):        0.604447373572   -8.797242999463   -0.072208358754
 Position (Angstrom):    0.319859775285   -4.655300514092   -0.038211017889
 Density of all electrons:  0.4436237883E+00
 Density of Alpha electrons:  0.2218118941E+00
 Density of Beta electrons:  0.2218118941E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6305370204E-02
 G(r) in X,Y,Z:  0.1838422569E-02  0.1728512261E-02  0.2738435373E-02
 Hamiltonian kinetic energy K(r):  0.6679593535E+01
 Potential energy density V(r): -0.6685898905E+01
 Energy density E(r) or H(r): -0.6679593535E+01
 Laplacian of electron density: -0.2669315266E+02
 Electron localization function (ELF):  0.9999273482E+00
 Localized orbital locator (LOL):  0.9915614032E+00
 Local information entropy:  0.6550741895E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4436237883E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2978866528E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5160397644E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2408829945E+00
 Wavefunction value for orbital         1 : -0.3919054498E-05
 Average local ionization energy (ALIE):  0.5310764164E+00
 Delta-g (under promolecular approximation):  0.1111845876E+00
 Delta-g (under Hirshfeld partition):  0.1973451453E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8257245142E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.5571562498E-15 -0.6435050120E-14  0.1828913540E-16
 Norm of gradient is:  0.6459150689E-14
 
 Components of Laplacian in x/y/z are:
 -0.8619641044E+01 -0.8998018488E+01 -0.9075493126E+01
 Total: -0.2669315266E+02
 
 Hessian matrix:
 -0.8619641044E+01 -0.2705024853E+00  0.1721437949E+00
 -0.2705024853E+00 -0.8998018488E+01 -0.8945034635E-01
  0.1721437949E+00 -0.8945034635E-01 -0.9075493126E+01
 Eigenvalues of Hessian: -0.9138932672E+01 -0.9133007989E+01 -0.8421211997E+01
 Eigenvectors(columns) of Hessian:
 -0.4697100655E+00 -0.2372939166E+00 -0.8503317303E+00
 -0.8822929794E+00  0.1594783931E+00  0.4428608592E+00
  0.3052135022E-01  0.9582579190E+00 -0.2842713631E+00
 Determinant of Hessian: -0.7028844182E+03
 Ellipticity of electron density:    0.000649
 eta index:   -1.085228
 
 ----------------   CP    15,     Type (3,-3)   ----------------
 Corresponding nucleus:    45(H )
 Position (Bohr):        5.139379926074   -9.066139116790    0.171822077961
 Position (Angstrom):    2.719642735051   -4.797594211481    0.090924327987
 Density of all electrons:  0.4388475583E+00
 Density of Alpha electrons:  0.2194237791E+00
 Density of Beta electrons:  0.2194237791E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6072657420E-02
 G(r) in X,Y,Z:  0.1596480873E-02  0.1644888085E-02  0.2831288462E-02
 Hamiltonian kinetic energy K(r):  0.6577275226E+01
 Potential energy density V(r): -0.6583347883E+01
 Energy density E(r) or H(r): -0.6577275226E+01
 Laplacian of electron density: -0.2628481027E+02
 Electron localization function (ELF):  0.9999301274E+00
 Localized orbital locator (LOL):  0.9917235390E+00
 Local information entropy:  0.6490278466E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4388475583E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2977045036E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5900867908E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2006803485E+00
 Wavefunction value for orbital         1 : -0.2772424071E-05
 Average local ionization energy (ALIE):  0.5465243533E+00
 Delta-g (under promolecular approximation):  0.1141634429E+00
 Delta-g (under Hirshfeld partition):  0.2030038328E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7707896841E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1465867595E-14 -0.3757012096E-14  0.1747598377E-16
 Norm of gradient is:  0.4032891408E-14
 
 Components of Laplacian in x/y/z are:
 -0.8610748412E+01 -0.8673453655E+01 -0.9000608206E+01
 Total: -0.2628481027E+02
 
 Hessian matrix:
 -0.8610748412E+01  0.3738619610E+00 -0.6826898710E-01
  0.3738619610E+00 -0.8673453655E+01 -0.6284634564E-01
 -0.6826898710E-01 -0.6284634564E-01 -0.9000608206E+01
 Eigenvalues of Hessian: -0.9017275742E+01 -0.9012161616E+01 -0.8255372915E+01
 Eigenvectors(columns) of Hessian:
 -0.6760781495E+00  0.9702083812E-01  0.7304144664E+00
  0.7367760470E+00  0.7702757035E-01  0.6717349254E+00
  0.8910233757E-02  0.9922971885E+00 -0.1235592868E+00
 Determinant of Hessian: -0.6708740879E+03
 Ellipticity of electron density:    0.000567
 eta index:   -1.092292
 
 ----------------   CP    16,     Type (3,-3)   ----------------
 Corresponding nucleus:    24(C )
 Position (Bohr):      -13.081445711457   -5.648982738776    4.480285406609
 Position (Angstrom):   -6.922402956168   -2.989312930145    2.370864935519
 Density of all electrons:  0.1221836697E+03
 Density of Alpha electrons:  0.6109183487E+02
 Density of Beta electrons:  0.6109183487E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8720341702E+01
 G(r) in X,Y,Z:  0.3185513762E+01  0.2928792575E+01  0.2606035365E+01
 Hamiltonian kinetic energy K(r):  0.2422566516E+06
 Potential energy density V(r): -0.2422653719E+06
 Energy density E(r) or H(r): -0.2422566516E+06
 Laplacian of electron density: -0.9689917250E+06
 Electron localization function (ELF):  0.9999989809E+00
 Localized orbital locator (LOL):  0.9989915104E+00
 Local information entropy:  0.3498422845E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221836697E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213978253E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4367153634E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5162409514E+04
 Wavefunction value for orbital         1 : -0.5320004888E-05
 Average local ionization energy (ALIE):  0.1019847480E+02
 Delta-g (under promolecular approximation):  0.4585144180E-01
 Delta-g (under Hirshfeld partition):  0.6094821620E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.2989373298E+08
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1374198746E-09 -0.1401424124E-09 -0.1180380884E-09
 Norm of gradient is:  0.2290351676E-09
 
 Components of Laplacian in x/y/z are:
 -0.3229963102E+06 -0.3229971692E+06 -0.3229982456E+06
 Total: -0.9689917250E+06
 
 Hessian matrix:
 -0.3229963102E+06 -0.2079009021E+00 -0.1754349724E+00
 -0.2079009021E+00 -0.3229971692E+06 -0.1434863099E+01
 -0.1754349724E+00 -0.1434863099E+01 -0.3229982456E+06
 Eigenvalues of Hessian: -0.3229992632E+06 -0.3229963211E+06 -0.3229961407E+06
 Eigenvectors(columns) of Hessian:
  0.8862910020E-01 -0.8966144628E+00  0.4338518039E+00
  0.5690027297E+00 -0.3119274046E+00 -0.7608792203E+00
  0.8175455805E+00  0.3142989013E+00  0.4825302316E+00
 Determinant of Hessian: -0.3369740369E+17
 Ellipticity of electron density:    0.000009
 eta index:   -1.000010
 
 ----------------   CP    17,     Type (3,-3)   ----------------
 Corresponding nucleus:    88(H )
 Position (Bohr):        0.933503798433   -7.502251864863    3.719623582197
 Position (Angstrom):    0.493988936422   -3.970020717340    1.968340032836
 Density of all electrons:  0.4136657525E+00
 Density of Alpha electrons:  0.2068328763E+00
 Density of Beta electrons:  0.2068328763E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1476005806E-01
 G(r) in X,Y,Z:  0.8040025808E-02  0.2349062043E-02  0.4370970206E-02
 Hamiltonian kinetic energy K(r):  0.5957855344E+01
 Potential energy density V(r): -0.5972615402E+01
 Energy density E(r) or H(r): -0.5957855344E+01
 Laplacian of electron density: -0.2377238114E+02
 Electron localization function (ELF):  0.9994985309E+00
 Localized orbital locator (LOL):  0.9781061146E+00
 Local information entropy:  0.6169645892E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4136657525E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2998525867E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8899607237E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2245234717E+00
 Wavefunction value for orbital         1 : -0.5721581088E-06
 Average local ionization energy (ALIE):  0.6856661737E+00
 Delta-g (under promolecular approximation):  0.1807267917E+00
 Delta-g (under Hirshfeld partition):  0.3009771423E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7139308458E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4162150496E-16  0.2170380261E-14  0.8503383875E-15
 Norm of gradient is:  0.2331385468E-14
 
 Components of Laplacian in x/y/z are:
 -0.8273242243E+01 -0.7191652775E+01 -0.8307486126E+01
 Total: -0.2377238114E+02
 
 Hessian matrix:
 -0.8273242243E+01 -0.2275595462E+00 -0.3891495991E-01
 -0.2275595462E+00 -0.7191652775E+01  0.1696646422E+00
 -0.3891495991E-01  0.1696646422E+00 -0.8307486126E+01
 Eigenvalues of Hessian: -0.8334343213E+01 -0.8317816024E+01 -0.7120221907E+01
 Eigenvectors(columns) of Hessian:
  0.3079760148E+00  0.9309255532E+00  0.1962864965E+00
 -0.7943658164E-01  0.2307553968E+00 -0.9697637735E+00
  0.9480720457E+00 -0.2830716540E+00 -0.1450166712E+00
 Determinant of Hessian: -0.4935989421E+03
 Ellipticity of electron density:    0.001987
 eta index:   -1.170517
 
 ----------------   CP    18,     Type (3,-3)   ----------------
 Corresponding nucleus:    75(C )
 Position (Bohr):       -1.125186456314   -7.915367616546   -0.687454650165
 Position (Angstrom):   -0.595423030698   -4.188632158596   -0.363785334396
 Density of all electrons:  0.1220226060E+03
 Density of Alpha electrons:  0.6101130300E+02
 Density of Beta electrons:  0.6101130300E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8577202898E+01
 G(r) in X,Y,Z:  0.3095558213E+01  0.2358897367E+01  0.3122747319E+01
 Hamiltonian kinetic energy K(r):  0.2419277034E+06
 Potential energy density V(r): -0.2419362806E+06
 Energy density E(r) or H(r): -0.2419277034E+06
 Laplacian of electron density: -0.9676765048E+06
 Electron localization function (ELF):  0.9999990097E+00
 Localized orbital locator (LOL):  0.9990058667E+00
 Local information entropy:  0.3497221306E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1220226060E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213903814E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1180127158E-02
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9596335973E+04
 Wavefunction value for orbital         1 : -0.1294043872E-04
 Average local ionization energy (ALIE):  0.1024253773E+02
 Delta-g (under promolecular approximation):  0.4096491144E-01
 Delta-g (under Hirshfeld partition):  0.5367068238E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1619611101E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3186810250E-11 -0.1264764516E-09  0.1294207356E-11
 Norm of gradient is:  0.1265232135E-09
 
 Components of Laplacian in x/y/z are:
 -0.3225579485E+06 -0.3225607342E+06 -0.3225578221E+06
 Total: -0.9676765048E+06
 
 Hessian matrix:
 -0.3225579485E+06 -0.1332994458E+00  0.1832458786E+00
 -0.1332994458E+00 -0.3225607342E+06 -0.8822651014E+00
  0.1832458786E+00 -0.8822651014E+00 -0.3225578221E+06
 Eigenvalues of Hessian: -0.3225609827E+06 -0.3225580429E+06 -0.3225574792E+06
 Eigenvectors(columns) of Hessian:
  0.2617018257E-01  0.9101110387E+00  0.4135372036E+00
  0.9632398142E+00  0.8768330778E-01 -0.2539304981E+00
  0.2673652593E+00 -0.4049809067E+00  0.8743604996E+00
 Determinant of Hessian: -0.3356037658E+17
 Ellipticity of electron density:    0.000009
 eta index:   -1.000011
 
 ----------------   CP    19,     Type (3,-3)   ----------------
 Corresponding nucleus:    91(H )
 Position (Bohr):       -1.115240764661   -7.983146478388   -2.717345440667
 Position (Angstrom):   -0.590159997328   -4.224499187663   -1.437957281352
 Density of all electrons:  0.4437897687E+00
 Density of Alpha electrons:  0.2218948843E+00
 Density of Beta electrons:  0.2218948843E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6120609717E-02
 G(r) in X,Y,Z:  0.2867237358E-02  0.1946565094E-02  0.1306807265E-02
 Hamiltonian kinetic energy K(r):  0.6674187357E+01
 Potential energy density V(r): -0.6680307966E+01
 Energy density E(r) or H(r): -0.6674187357E+01
 Laplacian of electron density: -0.2667226699E+02
 Electron localization function (ELF):  0.9999316220E+00
 Localized orbital locator (LOL):  0.9918117105E+00
 Local information entropy:  0.6552841115E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4437897687E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2978602252E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3668108403E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2495202061E+00
 Wavefunction value for orbital         1 : -0.1186662915E-04
 Average local ionization energy (ALIE):  0.5317574643E+00
 Delta-g (under promolecular approximation):  0.1125164275E+00
 Delta-g (under Hirshfeld partition):  0.2003107639E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8267271095E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.7483040575E-15  0.2071826495E-14 -0.6464640157E-15
 Norm of gradient is:  0.2295722046E-14
 
 Components of Laplacian in x/y/z are:
 -0.9132116828E+01 -0.9134541025E+01 -0.8405609135E+01
 Total: -0.2667226699E+02
 
 Hessian matrix:
 -0.9132116828E+01 -0.1506016423E-02 -0.7470832254E-02
 -0.1506016423E-02 -0.9134541025E+01  0.3327449286E-01
 -0.7470832254E-02  0.3327449286E-01 -0.8405609135E+01
 Eigenvalues of Hessian: -0.9136380708E+01 -0.9131870826E+01 -0.8404015455E+01
 Eigenvectors(columns) of Hessian:
 -0.2679830329E+00 -0.9633681033E+00 -0.1034367286E-01
 -0.9625470588E+00  0.2672658887E+00  0.4552037332E-01
  0.4108836479E-01 -0.2215495959E-01  0.9989098578E+00
 Determinant of Hessian: -0.7011659052E+03
 Ellipticity of electron density:    0.000494
 eta index:   -1.087145
 
 ----------------   CP    20,     Type (3,-3)   ----------------
 Corresponding nucleus:    13(C )
 Position (Bohr):        9.121743974974   -8.473119684605   -0.216235687667
 Position (Angstrom):    4.827019035248   -4.483781842346   -0.114426998098
 Density of all electrons:  0.1221926848E+03
 Density of Alpha electrons:  0.6109634238E+02
 Density of Beta electrons:  0.6109634238E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8718579631E+01
 G(r) in X,Y,Z:  0.3237262145E+01  0.3191855400E+01  0.2289462085E+01
 Hamiltonian kinetic energy K(r):  0.2422759078E+06
 Potential energy density V(r): -0.2422846264E+06
 Energy density E(r) or H(r): -0.2422759078E+06
 Laplacian of electron density: -0.9690687571E+06
 Electron localization function (ELF):  0.9999989816E+00
 Localized orbital locator (LOL):  0.9989918378E+00
 Local information entropy:  0.3498489964E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221926848E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213977578E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1151809607E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6193176040E+04
 Wavefunction value for orbital         1 : -0.1590551556E-05
 Average local ionization energy (ALIE):  0.1020487735E+02
 Delta-g (under promolecular approximation):  0.4773722573E-01
 Delta-g (under Hirshfeld partition):  0.6284624516E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1983701667E+08
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1709784617E-09  0.2559540272E-09 -0.3189792180E-11
 Norm of gradient is:  0.3078250691E-09
 
 Components of Laplacian in x/y/z are:
 -0.3230218047E+06 -0.3230219627E+06 -0.3230249897E+06
 Total: -0.9690687571E+06
 
 Hessian matrix:
 -0.3230218047E+06 -0.4499733580E-01 -0.2166906447E+00
 -0.4499733580E-01 -0.3230219627E+06 -0.2596380114E+00
 -0.2166906447E+00 -0.2596380114E+00 -0.3230249897E+06
 Eigenvalues of Hessian: -0.3230250268E+06 -0.3230219451E+06 -0.3230217852E+06
 Eigenvectors(columns) of Hessian:
  0.6803966897E-01  0.1670200165E+00  0.9836030284E+00
  0.8522857351E-01  0.9813107269E+00 -0.1725263677E+00
  0.9940355596E+00 -0.9556971996E-01 -0.5253317926E-01
 Determinant of Hessian: -0.3370544086E+17
 Ellipticity of electron density:    0.000010
 eta index:   -1.000010
 
 ----------------   CP    21,     Type (3,-3)   ----------------
 Corresponding nucleus:    21(C )
 Position (Bohr):       -7.934257231193   -5.108674167338    3.544668727343
 Position (Angstrom):   -4.198628112189   -2.703393947284    1.875757910710
 Density of all electrons:  0.1221995929E+03
 Density of Alpha electrons:  0.6109979647E+02
 Density of Beta electrons:  0.6109979647E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8762477864E+01
 G(r) in X,Y,Z:  0.3156981359E+01  0.2964658617E+01  0.2640837888E+01
 Hamiltonian kinetic energy K(r):  0.2422951450E+06
 Potential energy density V(r): -0.2423039075E+06
 Energy density E(r) or H(r): -0.2422951450E+06
 Laplacian of electron density: -0.9691455302E+06
 Electron localization function (ELF):  0.9999989715E+00
 Localized orbital locator (LOL):  0.9989868622E+00
 Local information entropy:  0.3498541388E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221995929E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213978018E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2596654174E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7650658188E+04
 Wavefunction value for orbital         1 :  0.1520096259E-05
 Average local ionization energy (ALIE):  0.1019837903E+02
 Delta-g (under promolecular approximation):  0.4575296081E-01
 Delta-g (under Hirshfeld partition):  0.6100147101E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.2058566710E+08
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1104981744E-09  0.1409270105E-09  0.5915103168E-10
 Norm of gradient is:  0.1885977555E-09
 
 Components of Laplacian in x/y/z are:
 -0.3230477465E+06 -0.3230483520E+06 -0.3230494316E+06
 Total: -0.9691455302E+06
 
 Hessian matrix:
 -0.3230477465E+06 -0.7897059301E-01 -0.2895355380E+00
 -0.7897059301E-01 -0.3230483520E+06 -0.1347703100E+01
 -0.2895355380E+00 -0.1347703100E+01 -0.3230494316E+06
 Eigenvalues of Hessian: -0.3230503744E+06 -0.3230477461E+06 -0.3230474097E+06
 Eigenvectors(columns) of Hessian:
  0.1075953512E+00  0.9482550738E+00  0.2987232086E+00
  0.5542385181E+00 -0.3066563343E+00  0.7738097684E+00
  0.8253744032E+00  0.8230557466E-01 -0.5585542829E+00
 Determinant of Hessian: -0.3371345230E+17
 Ellipticity of electron density:    0.000008
 eta index:   -1.000009
 
 ----------------   CP    22,     Type (3,-3)   ----------------
 Corresponding nucleus:    12(C )
 Position (Bohr):        6.611318405417   -7.710082350914   -0.077206693972
 Position (Angstrom):    3.498559034170   -4.079999874289   -0.040856022979
 Density of all electrons:  0.1221968203E+03
 Density of Alpha electrons:  0.6109841016E+02
 Density of Beta electrons:  0.6109841016E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8724611449E+01
 G(r) in X,Y,Z:  0.3232965353E+01  0.3214826946E+01  0.2276819150E+01
 Hamiltonian kinetic energy K(r):  0.2422852127E+06
 Potential energy density V(r): -0.2422939374E+06
 Energy density E(r) or H(r): -0.2422852127E+06
 Laplacian of electron density: -0.9691059525E+06
 Electron localization function (ELF):  0.9999989803E+00
 Localized orbital locator (LOL):  0.9989911979E+00
 Local information entropy:  0.3498520750E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221968203E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213980044E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.7137187650E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7592834196E+04
 Wavefunction value for orbital         1 : -0.3526423586E-05
 Average local ionization energy (ALIE):  0.1020531413E+02
 Delta-g (under promolecular approximation):  0.4812063213E-01
 Delta-g (under Hirshfeld partition):  0.6341318787E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.2383374721E+08
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.7406926266E-10  0.1383650022E-09  0.1640483756E-11
 Norm of gradient is:  0.1569516508E-09
 
 Components of Laplacian in x/y/z are:
 -0.3230342183E+06 -0.3230342886E+06 -0.3230374457E+06
 Total: -0.9691059525E+06
 
 Hessian matrix:
 -0.3230342183E+06 -0.9039844065E-01 -0.2680930076E+00
 -0.9039844065E-01 -0.3230342886E+06 -0.2595571822E+00
 -0.2680930076E+00 -0.2595571822E+00 -0.3230374457E+06
 Eigenvalues of Hessian: -0.3230374899E+06 -0.3230343083E+06 -0.3230341543E+06
 Eigenvectors(columns) of Hessian:
  0.8366374889E-01  0.5136500930E+00  0.8539109784E+00
  0.8287534775E-01  0.8503600344E+00 -0.5196339949E+00
  0.9930418188E+00 -0.1142426974E+00 -0.2857537830E-01
 Determinant of Hessian: -0.3370932213E+17
 Ellipticity of electron density:    0.000010
 eta index:   -1.000010
 
 ----------------   CP    23,     Type (3,-3)   ----------------
 Corresponding nucleus:    69(N )
 Position (Bohr):        0.578004147285   -5.694747825201    4.008282350977
 Position (Angstrom):    0.305866622551   -3.013530770936    2.121091675002
 Density of all electrons:  0.1981355862E+03
 Density of Alpha electrons:  0.9906779309E+02
 Density of Beta electrons:  0.9906779309E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2918633772E+02
 G(r) in X,Y,Z:  0.1096867602E+02  0.9158496713E+01  0.9059164983E+01
 Hamiltonian kinetic energy K(r):  0.5529760896E+06
 Potential energy density V(r): -0.5530052759E+06
 Energy density E(r) or H(r): -0.5529760896E+06
 Laplacian of electron density: -0.2211787613E+07
 Electron localization function (ELF):  0.9999977213E+00
 Localized orbital locator (LOL):  0.9984927506E+00
 Local information entropy:  0.3643794911E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1981355862E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931716916E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1727011947E-01
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2518765088E+05
 Wavefunction value for orbital         1 : -0.4069645147E-05
 Average local ionization energy (ALIE):  0.1424485351E+02
 Delta-g (under promolecular approximation):  0.5224991388E-01
 Delta-g (under Hirshfeld partition):  0.7597194123E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6735167951E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1466389117E-11 -0.3083350768E-09  0.1678876695E-09
 Norm of gradient is:  0.3510825252E-09
 
 Components of Laplacian in x/y/z are:
 -0.7372569286E+06 -0.7372651406E+06 -0.7372655438E+06
 Total: -0.2211787613E+07
 
 Hessian matrix:
 -0.7372569286E+06  0.2909758927E+01 -0.3026778540E+01
  0.2909758927E+01 -0.7372651406E+06  0.8860113998E-01
 -0.3026778540E+01  0.8860113998E-01 -0.7372655438E+06
 Eigenvalues of Hessian: -0.7372671788E+06 -0.7372652289E+06 -0.7372552054E+06
 Eigenvectors(columns) of Hessian:
  0.3773555790E+00 -0.4272463192E-01  0.9250823600E+00
 -0.5704335087E+00  0.7762043663E+00  0.2685375093E+00
  0.7295261333E+00  0.6290321038E+00 -0.2685334864E+00
 Determinant of Hessian: -0.4007435124E+18
 Ellipticity of electron density:    0.000003
 eta index:   -1.000016
 
 ----------------   CP    24,     Type (3,-3)   ----------------
 Corresponding nucleus:    97(H )
 Position (Bohr):        0.836786957984   -5.018839116189    5.725200460299
 Position (Angstrom):    0.442808588546   -2.655855285476    3.029645611442
 Density of all electrons:  0.4140452993E+00
 Density of Alpha electrons:  0.2070226496E+00
 Density of Beta electrons:  0.2070226496E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1442234255E-01
 G(r) in X,Y,Z:  0.8033537507E-02  0.4075835951E-02  0.2312969097E-02
 Hamiltonian kinetic energy K(r):  0.5960078941E+01
 Potential energy density V(r): -0.5974501283E+01
 Energy density E(r) or H(r): -0.5960078941E+01
 Laplacian of electron density: -0.2378262639E+02
 Electron localization function (ELF):  0.9995226507E+00
 Localized orbital locator (LOL):  0.9786283246E+00
 Local information entropy:  0.6174502174E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4140452993E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2997389868E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1743286830E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2470890262E+00
 Wavefunction value for orbital         1 :  0.1600554727E-05
 Average local ionization energy (ALIE):  0.6857572866E+00
 Delta-g (under promolecular approximation):  0.1813431230E+00
 Delta-g (under Hirshfeld partition):  0.3025028739E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7168665279E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3160347689E-15  0.2699791523E-15  0.6038438589E-15
 Norm of gradient is:  0.7330717044E-15
 
 Components of Laplacian in x/y/z are:
 -0.8301886426E+01 -0.8186041304E+01 -0.7294698663E+01
 Total: -0.2378262639E+02
 
 Hessian matrix:
 -0.8301886426E+01  0.6578212536E-01  0.1549846841E+00
  0.6578212536E-01 -0.8186041304E+01  0.3992359504E+00
  0.1549846841E+00  0.3992359504E+00 -0.7294698663E+01
 Eigenvalues of Hessian: -0.8341086675E+01 -0.8323427085E+01 -0.7118112634E+01
 Eigenvectors(columns) of Hessian:
  0.3631548425E+00 -0.9210401215E+00  0.1407254591E+00
 -0.8871669033E+00 -0.2956685624E+00  0.3542809433E+00
  0.2846988689E+00  0.2535058100E+00  0.9244897827E+00
 Determinant of Hessian: -0.4941851253E+03
 Ellipticity of electron density:    0.002122
 eta index:   -1.171812
 
 ----------------   CP    25,     Type (3,-3)   ----------------
 Corresponding nucleus:    50(H )
 Position (Bohr):       -5.966480538030   -4.880606354378    3.181653087707
 Position (Angstrom):   -3.157325530022   -2.582705658125    1.683658307014
 Density of all electrons:  0.4394376005E+00
 Density of Alpha electrons:  0.2197188003E+00
 Density of Beta electrons:  0.2197188003E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6310105573E-02
 G(r) in X,Y,Z:  0.1147170125E-02  0.2449439513E-02  0.2713495935E-02
 Hamiltonian kinetic energy K(r):  0.6606505716E+01
 Potential energy density V(r): -0.6612815822E+01
 Energy density E(r) or H(r): -0.6606505716E+01
 Laplacian of electron density: -0.2640078244E+02
 Electron localization function (ELF):  0.9999249032E+00
 Localized orbital locator (LOL):  0.9914217678E+00
 Local information entropy:  0.6497753889E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4394376005E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2980114989E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2243731210E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2519317807E+00
 Wavefunction value for orbital         1 :  0.3981512542E-06
 Average local ionization energy (ALIE):  0.5462434818E+00
 Delta-g (under promolecular approximation):  0.1148825355E+00
 Delta-g (under Hirshfeld partition):  0.2039502361E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8387299100E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2380594833E-14 -0.2167761976E-14  0.2020775290E-14
 Norm of gradient is:  0.3801309843E-14
 
 Components of Laplacian in x/y/z are:
 -0.8329078968E+01 -0.9044457351E+01 -0.9027246124E+01
 Total: -0.2640078244E+02
 
 Hessian matrix:
 -0.8329078968E+01  0.8223798817E-01 -0.1335298461E+00
  0.8223798817E-01 -0.9044457351E+01 -0.1298244482E-01
 -0.1335298461E+00 -0.1298244482E-01 -0.9027246124E+01
 Eigenvalues of Hessian: -0.9055144926E+01 -0.9050470348E+01 -0.8295167169E+01
 Eigenvectors(columns) of Hessian:
  0.1910185471E+00 -0.9046740217E-01  0.9774085961E+00
 -0.8263942038E+00 -0.5521638696E+00  0.1103978313E+00
  0.5297023076E+00 -0.8288128319E+00 -0.1802352769E+00
 Determinant of Hessian: -0.6798164948E+03
 Ellipticity of electron density:    0.000517
 eta index:   -1.091617
 
 ----------------   CP    26,     Type (3,-3)   ----------------
 Corresponding nucleus:    64(Cl)
 Position (Bohr):       -6.688855656438   -7.218167514523   -5.875468205321
 Position (Angstrom):   -3.539589980407   -3.819689753166   -3.109163877641
 Density of all electrons:  0.3103775848E+04
 Density of Alpha electrons:  0.1551887924E+04
 Density of Beta electrons:  0.1551887924E+04
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1434339449E+05
 G(r) in X,Y,Z:  0.4819470298E+04  0.4724851315E+04  0.4799072876E+04
 Hamiltonian kinetic energy K(r):  0.3939531995E+08
 Potential energy density V(r): -0.3940966335E+08
 Energy density E(r) or H(r): -0.3939531995E+08
 Laplacian of electron density: -0.1575239062E+09
 Electron localization function (ELF):  0.9999427853E+00
 Localized orbital locator (LOL):  0.9924925343E+00
 Local information entropy: -0.1238482632E+02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3103775848E+04
 Sign(lambda2)*rho with promolecular approximation: -0.3232820708E+04
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1662855272E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1093701128E+07
 Wavefunction value for orbital         1 :  0.3778175695E+02
 Average local ionization energy (ALIE):  0.9515222284E+02
 Delta-g (under promolecular approximation):  0.7493511690E-02
 Delta-g (under Hirshfeld partition):  0.3937127155E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.3254409250E+08
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1290161081E-07  0.2247201179E-07  0.2305507776E-07
 Norm of gradient is:  0.3468399466E-07
 
 Components of Laplacian in x/y/z are:
 -0.5250781602E+08 -0.5250819296E+08 -0.5250789725E+08
 Total: -0.1575239062E+09
 
 Hessian matrix:
 -0.5250781602E+08 -0.1397011805E+02 -0.3885494892E+02
 -0.1397011805E+02 -0.5250819296E+08 -0.1974318428E+03
 -0.3885494892E+02 -0.1974318428E+03 -0.5250789725E+08
 Eigenvalues of Hessian: -0.5250829364E+08 -0.5250783580E+08 -0.5250777679E+08
 Eigenvectors(columns) of Hessian:
 -0.6265603260E-01 -0.7940197432E+00  0.6046543384E+00
 -0.8908938001E+00  0.3175843173E+00  0.3247282531E+00
 -0.4498693794E+00 -0.5183366173E+00 -0.7272858397E+00
 Determinant of Hessian: -0.1447690265E+24
 Ellipticity of electron density:    0.000009
 eta index:   -1.000010
 
 ----------------   CP    27,     Type (3,-3)   ----------------
 Corresponding nucleus:    23(C )
 Position (Bohr):      -12.225512908475   -3.660516622865    2.987823393022
 Position (Angstrom):   -6.469462822765   -1.937061976952    1.581088049790
 Density of all electrons:  0.1221923658E+03
 Density of Alpha electrons:  0.6109618290E+02
 Density of Beta electrons:  0.6109618290E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8758489334E+01
 G(r) in X,Y,Z:  0.3165965554E+01  0.2936969048E+01  0.2655554732E+01
 Hamiltonian kinetic energy K(r):  0.2422785665E+06
 Potential energy density V(r): -0.2422873250E+06
 Energy density E(r) or H(r): -0.2422785665E+06
 Laplacian of electron density: -0.9690792320E+06
 Electron localization function (ELF):  0.9999989722E+00
 Localized orbital locator (LOL):  0.9989872232E+00
 Local information entropy:  0.3498487590E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221923658E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213977111E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1314819977E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5883705710E+04
 Wavefunction value for orbital         1 : -0.3459976296E-06
 Average local ionization energy (ALIE):  0.1019883326E+02
 Delta-g (under promolecular approximation):  0.4614335764E-01
 Delta-g (under Hirshfeld partition):  0.6144675333E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1937894239E+08
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1442477391E-09 -0.4764722656E-10 -0.6821307936E-10
 Norm of gradient is:  0.1665253513E-09
 
 Components of Laplacian in x/y/z are:
 -0.3230256199E+06 -0.3230263438E+06 -0.3230272684E+06
 Total: -0.9690792320E+06
 
 Hessian matrix:
 -0.3230256199E+06 -0.1076761897E+00 -0.3199816121E+00
 -0.1076761897E+00 -0.3230263438E+06 -0.1371154467E+01
 -0.3199816121E+00 -0.1371154467E+01 -0.3230272684E+06
 Eigenvalues of Hessian: -0.3230282921E+06 -0.3230256183E+06 -0.3230253216E+06
 Eigenvectors(columns) of Hessian:
  0.1200428198E+00  0.9279162287E+00  0.3529322794E+00
  0.5757869786E+00 -0.3546779007E+00  0.7366633845E+00
  0.8087391895E+00  0.1147826609E+00 -0.5768586170E+00
 Determinant of Hessian: -0.3370653387E+17
 Ellipticity of electron density:    0.000008
 eta index:   -1.000009
 
 ----------------   CP    28,     Type (3,-3)   ----------------
 Corresponding nucleus:    47(H )
 Position (Bohr):       12.942521911932   -7.246492372021   -0.644365996307
 Position (Angstrom):    6.848887647407   -3.834678622256   -0.340983800727
 Density of all electrons:  0.4374465347E+00
 Density of Alpha electrons:  0.2187232673E+00
 Density of Beta electrons:  0.2187232673E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6309834878E-02
 G(r) in X,Y,Z:  0.1289025842E-02  0.2125559133E-02  0.2895249903E-02
 Hamiltonian kinetic energy K(r):  0.6541018399E+01
 Potential energy density V(r): -0.6547328233E+01
 Energy density E(r) or H(r): -0.6541018399E+01
 Laplacian of electron density: -0.2613883425E+02
 Electron localization function (ELF):  0.9999237644E+00
 Localized orbital locator (LOL):  0.9913575260E+00
 Local information entropy:  0.6472521738E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4374465347E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2977051900E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6761730283E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1400991026E+00
 Wavefunction value for orbital         1 :  0.1220279349E-06
 Average local ionization energy (ALIE):  0.5483838450E+00
 Delta-g (under promolecular approximation):  0.1155615113E+00
 Delta-g (under Hirshfeld partition):  0.2057487773E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7216700687E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.6361075132E-14  0.2982396231E-14  0.1286947979E-15
 Norm of gradient is:  0.7026700966E-14
 
 Components of Laplacian in x/y/z are:
 -0.8259474335E+01 -0.8912867346E+01 -0.8966492574E+01
 Total: -0.2613883425E+02
 
 Hessian matrix:
 -0.8259474335E+01 -0.2100056582E+00 -0.4802208387E-01
 -0.2100056582E+00 -0.8912867346E+01  0.1481240933E-01
 -0.4802208387E-01  0.1481240933E-01 -0.8966492574E+01
 Eigenvalues of Hessian: -0.8974637608E+01 -0.8969668989E+01 -0.8194527657E+01
 Eigenvectors(columns) of Hessian:
 -0.2705479250E+00  0.1006057740E+00 -0.9574352712E+00
 -0.9528142924E+00  0.1142214373E+00  0.2812443555E+00
  0.1376544388E+00  0.9883480872E+00  0.6495624648E-01
 Determinant of Hessian: -0.6596556139E+03
 Ellipticity of electron density:    0.000554
 eta index:   -1.095199
 
 ----------------   CP    29,     Type (3,-3)   ----------------
 Corresponding nucleus:    67(N )
 Position (Bohr):       -1.086608063531   -5.241788724600   -0.011412982001
 Position (Angstrom):   -0.575008224404   -2.773835137426   -0.006039489984
 Density of all electrons:  0.1982125393E+03
 Density of Alpha electrons:  0.9910626966E+02
 Density of Beta electrons:  0.9910626966E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2891551496E+02
 G(r) in X,Y,Z:  0.1097342408E+02  0.8877253033E+01  0.9064837847E+01
 Hamiltonian kinetic energy K(r):  0.5532264502E+06
 Potential energy density V(r): -0.5532553657E+06
 Energy density E(r) or H(r): -0.5532264502E+06
 Laplacian of electron density: -0.2212790139E+07
 Electron localization function (ELF):  0.9999977663E+00
 Localized orbital locator (LOL):  0.9985076803E+00
 Local information entropy:  0.3643579431E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1982125393E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931722441E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1557855828E-01
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3289375955E+05
 Wavefunction value for orbital         1 :  0.2955985438E-04
 Average local ionization energy (ALIE):  0.1424168423E+02
 Delta-g (under promolecular approximation):  0.5053817807E-01
 Delta-g (under Hirshfeld partition):  0.7471425529E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6426634447E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5166389538E-10 -0.3204502380E-09  0.1166974503E-12
 Norm of gradient is:  0.3245882418E-09
 
 Components of Laplacian in x/y/z are:
 -0.7375908214E+06 -0.7376000365E+06 -0.7375992807E+06
 Total: -0.2212790139E+07
 
 Hessian matrix:
 -0.7375908214E+06  0.9381261488E+00 -0.3732784636E+01
  0.9381261488E+00 -0.7376000365E+06 -0.1223922378E+01
 -0.3732784636E+01 -0.1223922378E+01 -0.7375992807E+06
 Eigenvalues of Hessian: -0.7376012889E+06 -0.7375996000E+06 -0.7375892497E+06
 Eigenvectors(columns) of Hessian:
 -0.2236471889E+00 -0.3060483729E+00 -0.9253736156E+00
 -0.5903727250E+00  0.7979744314E+00 -0.1212305756E+00
 -0.7755269051E+00 -0.5192024656E+00  0.3591473502E+00
 Determinant of Hessian: -0.4012886882E+18
 Ellipticity of electron density:    0.000002
 eta index:   -1.000016
 
 ----------------   CP    30,     Type (3,-3)   ----------------
 Corresponding nucleus:    14(C )
 Position (Bohr):       11.017609386510   -6.676554775336   -0.515587227257
 Position (Angstrom):    5.830267805972   -3.533080634453   -0.272837010897
 Density of all electrons:  0.1221978863E+03
 Density of Alpha electrons:  0.6109894316E+02
 Density of Beta electrons:  0.6109894316E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8730154568E+01
 G(r) in X,Y,Z:  0.3268073853E+01  0.3163898956E+01  0.2298181759E+01
 Hamiltonian kinetic energy K(r):  0.2422890185E+06
 Potential energy density V(r): -0.2422977486E+06
 Energy density E(r) or H(r): -0.2422890185E+06
 Laplacian of electron density: -0.9691211532E+06
 Electron localization function (ELF):  0.9999989790E+00
 Localized orbital locator (LOL):  0.9989905722E+00
 Local information entropy:  0.3498528685E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221978863E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213971313E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1799772368E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5981548074E+04
 Wavefunction value for orbital         1 : -0.7941016282E-06
 Average local ionization energy (ALIE):  0.1020851266E+02
 Delta-g (under promolecular approximation):  0.4694255731E-01
 Delta-g (under Hirshfeld partition):  0.6211186018E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7420292663E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.8561922330E-10 -0.5808481945E-10  0.1783200670E-10
 Norm of gradient is:  0.1049879903E-09
 
 Components of Laplacian in x/y/z are:
 -0.3230391438E+06 -0.3230395712E+06 -0.3230424382E+06
 Total: -0.9691211532E+06
 
 Hessian matrix:
 -0.3230391438E+06  0.5995620770E-01 -0.3141063442E+00
  0.5995620770E-01 -0.3230395712E+06 -0.2117334268E+00
 -0.3141063442E+00 -0.2117334268E+00 -0.3230424382E+06
 Eigenvalues of Hessian: -0.3230424824E+06 -0.3230395705E+06 -0.3230391003E+06
 Eigenvectors(columns) of Hessian:
  0.9218613652E-01  0.1771977208E+00  0.9798482964E+00
  0.7034150464E-01 -0.9827390138E+00  0.1711026109E+00
  0.9932541412E+00  0.5315071484E-01 -0.1030592672E+00
 Determinant of Hessian: -0.3371090837E+17
 Ellipticity of electron density:    0.000009
 eta index:   -1.000010
 
 ----------------   CP    31,     Type (3,-3)   ----------------
 Corresponding nucleus:    22(C )
 Position (Bohr):       -9.653611735936   -3.404149759958    2.515709017655
 Position (Angstrom):   -5.108471333563   -1.801398475470    1.331255881406
 Density of all electrons:  0.1221487141E+03
 Density of Alpha electrons:  0.6107435703E+02
 Density of Beta electrons:  0.6107435703E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8608191618E+01
 G(r) in X,Y,Z:  0.3321424380E+01  0.2696759591E+01  0.2590007646E+01
 Hamiltonian kinetic energy K(r):  0.2421983930E+06
 Potential energy density V(r): -0.2422070012E+06
 Energy density E(r) or H(r): -0.2421983930E+06
 Laplacian of electron density: -0.9687591393E+06
 Electron localization function (ELF):  0.9999990060E+00
 Localized orbital locator (LOL):  0.9990039930E+00
 Local information entropy:  0.3498162457E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221487141E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213933206E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1117981460E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7313593981E+04
 Wavefunction value for orbital         1 : -0.7471082149E-05
 Average local ionization energy (ALIE):  0.1024585374E+02
 Delta-g (under promolecular approximation):  0.4009535066E-01
 Delta-g (under Hirshfeld partition):  0.5209765305E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1583688710E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1633853789E-09  0.6401270529E-10  0.2817058652E-11
 Norm of gradient is:  0.1755002687E-09
 
 Components of Laplacian in x/y/z are:
 -0.3229181953E+06 -0.3229203458E+06 -0.3229205982E+06
 Total: -0.9687591393E+06
 
 Hessian matrix:
 -0.3229181953E+06 -0.9174964370E+00  0.2958599914E+00
 -0.9174964370E+00 -0.3229203458E+06  0.1454972829E+00
  0.2958599914E+00  0.1454972829E+00 -0.3229205982E+06
 Eigenvalues of Hessian: -0.3229208910E+06 -0.3229204102E+06 -0.3229178382E+06
 Eigenvectors(columns) of Hessian:
 -0.3070907590E+00  0.1640192780E+00  0.9374395672E+00
 -0.6913860318E+00  0.6384441370E+00 -0.3381929020E+00
  0.6539729511E+00  0.7519885374E+00  0.8265965686E-01
 Determinant of Hessian: -0.3367314449E+17
 Ellipticity of electron density:    0.000001
 eta index:   -1.000009
 
 ----------------   CP    32,     Type (3,-3)   ----------------
 Corresponding nucleus:    73(C )
 Position (Bohr):       -0.487791293529   -4.241292700000    2.226103154421
 Position (Angstrom):   -0.258128036213   -2.244395441609    1.178003058439
 Density of all electrons:  0.1221768882E+03
 Density of Alpha electrons:  0.6108844412E+02
 Density of Beta electrons:  0.6108844412E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8216042678E+01
 G(r) in X,Y,Z:  0.2252057757E+01  0.3091090730E+01  0.2872894190E+01
 Hamiltonian kinetic energy K(r):  0.2422695102E+06
 Potential energy density V(r): -0.2422777262E+06
 Energy density E(r) or H(r): -0.2422695102E+06
 Laplacian of electron density: -0.9690451767E+06
 Electron localization function (ELF):  0.9999990952E+00
 Localized orbital locator (LOL):  0.9990496883E+00
 Local information entropy:  0.3498372346E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221768882E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213976031E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5703323388E-02
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1601615786E+05
 Wavefunction value for orbital         1 : -0.3088788202E-05
 Average local ionization energy (ALIE):  0.1034296864E+02
 Delta-g (under promolecular approximation):  0.5494348678E-01
 Delta-g (under Hirshfeld partition):  0.6967645500E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7133822175E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2704596692E-11  0.1141113487E-09  0.6180988327E-10
 Norm of gradient is:  0.1298043775E-09
 
 Components of Laplacian in x/y/z are:
 -0.3230166600E+06 -0.3230138669E+06 -0.3230146497E+06
 Total: -0.9690451767E+06
 
 Hessian matrix:
 -0.3230166600E+06 -0.2721409298E+00  0.9165596322E+00
 -0.2721409298E+00 -0.3230138669E+06  0.3059166499E+00
  0.9165596322E+00  0.3059166499E+00 -0.3230146497E+06
 Eigenvalues of Hessian: -0.3230170569E+06 -0.3230143591E+06 -0.3230137607E+06
 Eigenvectors(columns) of Hessian:
  0.9235654826E+00 -0.3828781463E+00 -0.2076353646E-01
  0.1139006835E+00  0.3256480095E+00 -0.9386053528E+00
 -0.3661330819E+00 -0.8644985246E+00 -0.3443673436E+00
 Determinant of Hessian: -0.3370298045E+17
 Ellipticity of electron density:    0.000008
 eta index:   -1.000010
 
 ----------------   CP    33,     Type (3,-3)   ----------------
 Corresponding nucleus:    51(H )
 Position (Bohr):      -13.523414086273   -2.335213967029    2.197111394271
 Position (Angstrom):   -7.156282548060   -1.235742013934    1.162661279663
 Density of all electrons:  0.4377802131E+00
 Density of Alpha electrons:  0.2188901066E+00
 Density of Beta electrons:  0.2188901066E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6171918715E-02
 G(r) in X,Y,Z:  0.1694321620E-02  0.1943663309E-02  0.2533933786E-02
 Hamiltonian kinetic energy K(r):  0.6560074401E+01
 Potential energy density V(r): -0.6566246319E+01
 Energy density E(r) or H(r): -0.6560074401E+01
 Laplacian of electron density: -0.2621560993E+02
 Electron localization function (ELF):  0.9999272403E+00
 Localized orbital locator (LOL):  0.9915554778E+00
 Local information entropy:  0.6476751677E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4377802131E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2977020040E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.7185510788E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1501024735E+00
 Wavefunction value for orbital         1 : -0.1892164798E-05
 Average local ionization energy (ALIE):  0.5456148099E+00
 Delta-g (under promolecular approximation):  0.1141986552E+00
 Delta-g (under Hirshfeld partition):  0.2023694642E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7312908613E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1722838571E-14 -0.3091285916E-15  0.2716572305E-15
 Norm of gradient is:  0.1771307675E-14
 
 Components of Laplacian in x/y/z are:
 -0.8677723352E+01 -0.8664949245E+01 -0.8872937331E+01
 Total: -0.2621560993E+02
 
 Hessian matrix:
 -0.8677723352E+01 -0.3195792888E+00  0.1915360077E+00
 -0.3195792888E+00 -0.8664949245E+01 -0.1921894211E+00
  0.1915360077E+00 -0.1921894211E+00 -0.8872937331E+01
 Eigenvalues of Hessian: -0.8992161156E+01 -0.8987354716E+01 -0.8236094055E+01
 Eigenvectors(columns) of Hessian:
  0.7555859370E+00  0.1152747134E+00  0.6448268235E+00
  0.4699083748E+00  0.5904411754E+00 -0.6561747767E+00
 -0.4563726669E+00  0.7988059582E+00  0.3919604955E+00
 Determinant of Hessian: -0.6656060520E+03
 Ellipticity of electron density:    0.000535
 eta index:   -1.091799
 
 ----------------   CP    34,     Type (3,-3)   ----------------
 Corresponding nucleus:    11(C )
 Position (Bohr):        6.013065647438   -5.166561874611   -0.237793749872
 Position (Angstrom):    3.181977308288   -2.734026802764   -0.125835033327
 Density of all electrons:  0.1222001800E+03
 Density of Alpha electrons:  0.6110008998E+02
 Density of Beta electrons:  0.6110008998E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8756459235E+01
 G(r) in X,Y,Z:  0.3165729763E+01  0.3239247112E+01  0.2351482359E+01
 Hamiltonian kinetic energy K(r):  0.2422957588E+06
 Potential energy density V(r): -0.2423045153E+06
 Energy density E(r) or H(r): -0.2422957588E+06
 Laplacian of electron density: -0.9691480094E+06
 Electron localization function (ELF):  0.9999989729E+00
 Localized orbital locator (LOL):  0.9989875655E+00
 Local information entropy:  0.3498545757E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1222001800E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213971826E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1508533886E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9723692572E+04
 Wavefunction value for orbital         1 :  0.2233453892E-05
 Average local ionization energy (ALIE):  0.1020709689E+02
 Delta-g (under promolecular approximation):  0.4543216378E-01
 Delta-g (under Hirshfeld partition):  0.6039920113E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8575104795E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1256162492E-10  0.2396344755E-10  0.2253544573E-12
 Norm of gradient is:  0.2705719911E-10
 
 Components of Laplacian in x/y/z are:
 -0.3230485159E+06 -0.3230482857E+06 -0.3230512078E+06
 Total: -0.9691480094E+06
 
 Hessian matrix:
 -0.3230485159E+06 -0.2693502031E+00 -0.4073113858E+00
 -0.2693502031E+00 -0.3230482857E+06 -0.2746270396E+00
 -0.4073113858E+00 -0.2746270396E+00 -0.3230512078E+06
 Eigenvalues of Hessian: -0.3230513004E+06 -0.3230486012E+06 -0.3230481079E+06
 Eigenvectors(columns) of Hessian:
  0.1537373332E+00  0.8211303968E+00  0.5496450708E+00
  0.1032551733E+00  0.5398622727E+00 -0.8353963704E+00
  0.9827019902E+00 -0.1851853072E+00  0.1788975288E-02
 Determinant of Hessian: -0.3371371103E+17
 Ellipticity of electron density:    0.000008
 eta index:   -1.000010
 
 ----------------   CP    35,     Type (3,-3)   ----------------
 Corresponding nucleus:    62(N )
 Position (Bohr):       -7.760967038662   -4.022220193357   -2.264412352647
 Position (Angstrom):   -4.106926891429   -2.128467263558   -1.198275413108
 Density of all electrons:  0.1987170253E+03
 Density of Alpha electrons:  0.9935851263E+02
 Density of Beta electrons:  0.9935851263E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2773023856E+02
 G(r) in X,Y,Z:  0.9293785752E+01  0.9647327099E+01  0.8789125709E+01
 Hamiltonian kinetic energy K(r):  0.5547321340E+06
 Potential energy density V(r): -0.5547598643E+06
 Energy density E(r) or H(r): -0.5547321340E+06
 Laplacian of electron density: -0.2218817615E+07
 Electron localization function (ELF):  0.9999979630E+00
 Localized orbital locator (LOL):  0.9985748065E+00
 Local information entropy:  0.3642151133E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1987170253E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931537634E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3658254062E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1955377322E+05
 Wavefunction value for orbital         1 :  0.5360231533E-04
 Average local ionization energy (ALIE):  0.1417991478E+02
 Delta-g (under promolecular approximation):  0.6152099140E-01
 Delta-g (under Hirshfeld partition):  0.8848541547E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.9930982742E+06
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3007228397E-09  0.2402575085E-09  0.1608393279E-09
 Norm of gradient is:  0.4171656579E-09
 
 Components of Laplacian in x/y/z are:
 -0.7396054210E+06 -0.7396040497E+06 -0.7396081444E+06
 Total: -0.2218817615E+07
 
 Hessian matrix:
 -0.7396054210E+06  0.4464096418E+01 -0.2147993796E+01
  0.4464096418E+01 -0.7396040497E+06 -0.4460353190E+01
 -0.2147993796E+01 -0.4460353190E+01 -0.7396081444E+06
 Eigenvalues of Hessian: -0.7396111160E+06 -0.7396085556E+06 -0.7395979435E+06
 Eigenvectors(columns) of Hessian:
  0.1808321884E+00 -0.8148771456E+00 -0.5507040560E+00
 -0.6041294263E+00  0.3498170601E+00 -0.7159997631E+00
 -0.7760975171E+00 -0.4621723294E+00  0.4290330779E+00
 Determinant of Hessian: -0.4045768708E+18
 Ellipticity of electron density:    0.000003
 eta index:   -1.000018
 
 ----------------   CP    36,     Type (3,-3)   ----------------
 Corresponding nucleus:    44(H )
 Position (Bohr):        4.103214348736   -4.556187047423   -0.098701791202
 Position (Angstrom):    2.171327524801   -2.411030354108   -0.052230738579
 Density of all electrons:  0.4397842032E+00
 Density of Alpha electrons:  0.2198921016E+00
 Density of Beta electrons:  0.2198921016E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6727109068E-02
 G(r) in X,Y,Z:  0.1377683939E-02  0.2281298847E-02  0.3068126283E-02
 Hamiltonian kinetic energy K(r):  0.6607456053E+01
 Potential energy density V(r): -0.6614183162E+01
 Energy density E(r) or H(r): -0.6607456053E+01
 Laplacian of electron density: -0.2640291578E+02
 Electron localization function (ELF):  0.9999148912E+00
 Localized orbital locator (LOL):  0.9908719494E+00
 Local information entropy:  0.6502144321E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4397842032E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2983164774E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6122572666E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3426253687E+00
 Wavefunction value for orbital         1 : -0.3656707649E-06
 Average local ionization energy (ALIE):  0.5521044731E+00
 Delta-g (under promolecular approximation):  0.1160911559E+00
 Delta-g (under Hirshfeld partition):  0.2065701163E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8678770054E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2271633944E-14  0.2363655604E-14  0.2054563117E-16
 Norm of gradient is:  0.3278354879E-14
 
 Components of Laplacian in x/y/z are:
 -0.8361498972E+01 -0.8989358466E+01 -0.9052058338E+01
 Total: -0.2640291578E+02
 
 Hessian matrix:
 -0.8361498972E+01 -0.2228660118E+00 -0.4864675664E-01
 -0.2228660118E+00 -0.8989358466E+01  0.1593798312E-01
 -0.4864675664E-01  0.1593798312E-01 -0.9052058338E+01
 Eigenvalues of Hessian: -0.9060456688E+01 -0.9055450449E+01 -0.8287008638E+01
 Eigenvectors(columns) of Hessian:
 -0.2976677058E+00  0.8805421314E-01 -0.9506000171E+00
 -0.9512287611E+00  0.5710719618E-01  0.3031544362E+00
  0.8098012701E-01  0.9944773621E+00  0.6676073201E-01
 Determinant of Hessian: -0.6799201917E+03
 Ellipticity of electron density:    0.000553
 eta index:   -1.093333
 
 ----------------   CP    37,     Type (3,-3)   ----------------
 Corresponding nucleus:    89(H )
 Position (Bohr):       -1.833536812680   -4.023362723507   -1.211250020586
 Position (Angstrom):   -0.970265896622   -2.129071864476   -0.640965907600
 Density of all electrons:  0.4195869685E+00
 Density of Alpha electrons:  0.2097934843E+00
 Density of Beta electrons:  0.2097934843E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1485786340E-01
 G(r) in X,Y,Z:  0.7652592093E-02  0.3434928953E-02  0.3770342355E-02
 Hamiltonian kinetic energy K(r):  0.6066800891E+01
 Potential energy density V(r): -0.6081658754E+01
 Energy density E(r) or H(r): -0.6066800891E+01
 Laplacian of electron density: -0.2420777211E+02
 Electron localization function (ELF):  0.9995153709E+00
 Localized orbital locator (LOL):  0.9784689681E+00
 Local information entropy:  0.6245323961E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4195869685E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3004647948E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4409896466E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.4202091166E+00
 Wavefunction value for orbital         1 :  0.2208732058E-05
 Average local ionization energy (ALIE):  0.6705120337E+00
 Delta-g (under promolecular approximation):  0.1808273083E+00
 Delta-g (under Hirshfeld partition):  0.3040842535E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8096507364E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.8666231253E-15  0.3788405679E-15 -0.3730807438E-15
 Norm of gradient is:  0.1016732540E-14
 
 Components of Laplacian in x/y/z are:
 -0.8272778393E+01 -0.7959738963E+01 -0.7975254755E+01
 Total: -0.2420777211E+02
 
 Hessian matrix:
 -0.8272778393E+01 -0.3133608563E+00  0.3037466615E+00
 -0.3133608563E+00 -0.7959738963E+01 -0.5136996589E+00
  0.3037466615E+00 -0.5136996589E+00 -0.7975254755E+01
 Eigenvalues of Hessian: -0.8481772054E+01 -0.8461200593E+01 -0.7264799462E+01
 Eigenvectors(columns) of Hessian:
  0.1456998698E+00 -0.9060439899E+00 -0.3973107554E+00
  0.7369644169E+00 -0.1685322965E+00  0.6545840766E+00
  0.6600416625E+00  0.3881767039E+00 -0.6431670470E+00
 Determinant of Hessian: -0.5213654147E+03
 Ellipticity of electron density:    0.002431
 eta index:   -1.167516
 
 ----------------   CP    38,     Type (3,-3)   ----------------
 Corresponding nucleus:    19(C )
 Position (Bohr):       -6.475579500928   -4.242532961796   -4.364505616032
 Position (Angstrom):   -3.426729099282   -2.245051759887   -2.309596908863
 Density of all electrons:  0.1222147501E+03
 Density of Alpha electrons:  0.6110737504E+02
 Density of Beta electrons:  0.6110737504E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8133336526E+01
 G(r) in X,Y,Z:  0.2675990097E+01  0.2575808460E+01  0.2881537969E+01
 Hamiltonian kinetic energy K(r):  0.2423443477E+06
 Potential energy density V(r): -0.2423524810E+06
 Energy density E(r) or H(r): -0.2423443477E+06
 Laplacian of electron density: -0.9693448575E+06
 Electron localization function (ELF):  0.9999991142E+00
 Localized orbital locator (LOL):  0.9990597307E+00
 Local information entropy:  0.3498654187E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1222147501E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213909848E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5619789638E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8679741449E+04
 Wavefunction value for orbital         1 :  0.1434840648E-03
 Average local ionization energy (ALIE):  0.1033968443E+02
 Delta-g (under promolecular approximation):  0.3676003105E-01
 Delta-g (under Hirshfeld partition):  0.4760858427E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1602727173E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.7454068818E-10 -0.2336561782E-10 -0.2824785761E-11
 Norm of gradient is:  0.7816806065E-10
 
 Components of Laplacian in x/y/z are:
 -0.3231150047E+06 -0.3231154537E+06 -0.3231143990E+06
 Total: -0.9693448575E+06
 
 Hessian matrix:
 -0.3231150047E+06  0.5858367503E+00 -0.1329485003E+01
  0.5858367503E+00 -0.3231154537E+06 -0.5205287095E+00
 -0.1329485003E+01 -0.5205287095E+00 -0.3231143990E+06
 Eigenvalues of Hessian: -0.3231161061E+06 -0.3231156655E+06 -0.3231130858E+06
 Eigenvectors(columns) of Hessian:
 -0.7958214232E+00  0.4858211535E-01 -0.6035793572E+00
  0.2909147239E+00  0.9048814533E+00 -0.3107381196E+00
 -0.5310714507E+00  0.4228821746E+00  0.7342572986E+00
 Determinant of Hessian: -0.3373425844E+17
 Ellipticity of electron density:    0.000001
 eta index:   -1.000009
 
 ----------------   CP    39,     Type (3,-3)   ----------------
 Corresponding nucleus:    15(C )
 Position (Bohr):       10.427659026877   -4.123371452117   -0.656833252572
 Position (Angstrom):    5.518079520090   -2.181994204548   -0.347581188624
 Density of all electrons:  0.1222010979E+03
 Density of Alpha electrons:  0.6110054896E+02
 Density of Beta electrons:  0.6110054896E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8626957711E+01
 G(r) in X,Y,Z:  0.2950563351E+01  0.3126998389E+01  0.2549395971E+01
 Hamiltonian kinetic energy K(r):  0.2423064921E+06
 Potential energy density V(r): -0.2423151191E+06
 Energy density E(r) or H(r): -0.2423064921E+06
 Laplacian of electron density: -0.9691914607E+06
 Electron localization function (ELF):  0.9999990031E+00
 Localized orbital locator (LOL):  0.9990025362E+00
 Local information entropy:  0.3498552590E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1222010979E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213921115E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3597460301E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6866290738E+04
 Wavefunction value for orbital         1 :  0.2318329819E-07
 Average local ionization energy (ALIE):  0.1023310116E+02
 Delta-g (under promolecular approximation):  0.2907685520E-01
 Delta-g (under Hirshfeld partition):  0.3920370918E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.3229171390E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.7170682798E-10  0.1143885388E-09  0.7121258444E-11
 Norm of gradient is:  0.1351936364E-09
 
 Components of Laplacian in x/y/z are:
 -0.3230636948E+06 -0.3230630110E+06 -0.3230647550E+06
 Total: -0.9691914607E+06
 
 Hessian matrix:
 -0.3230636948E+06 -0.8747857109E+00 -0.1093836951E+00
 -0.8747857109E+00 -0.3230630110E+06  0.9994447715E-02
 -0.1093836951E+00  0.9994447715E-02 -0.3230647550E+06
 Eigenvalues of Hessian: -0.3230647720E+06 -0.3230642772E+06 -0.3230624116E+06
 Eigenvectors(columns) of Hessian:
  0.1599332672E+00 -0.8096075686E+00 -0.5647627244E+00
  0.7385966260E-01 -0.5607088543E+00  0.8247122716E+00
  0.9843607572E+00  0.1736121124E+00  0.2987865715E-01
 Determinant of Hessian: -0.3371824585E+17
 Ellipticity of electron density:    0.000002
 eta index:   -1.000007
 
 ----------------   CP    40,     Type (3,-3)   ----------------
 Corresponding nucleus:    68(N )
 Position (Bohr):       -1.082624638203   -1.813791566718    2.576424995644
 Position (Angstrom):   -0.572900286499   -0.959817162435    1.363385393296
 Density of all electrons:  0.1984696070E+03
 Density of Alpha electrons:  0.9923480349E+02
 Density of Beta electrons:  0.9923480349E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2831019238E+02
 G(r) in X,Y,Z:  0.1015268450E+02  0.8318291366E+01  0.9839216520E+01
 Hamiltonian kinetic energy K(r):  0.5540071740E+06
 Potential energy density V(r): -0.5540354842E+06
 Energy density E(r) or H(r): -0.5540071740E+06
 Laplacian of electron density: -0.2215915455E+07
 Electron localization function (ELF):  0.9999978681E+00
 Localized orbital locator (LOL):  0.9985420234E+00
 Local information entropy:  0.3642855018E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1984696070E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931561002E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3514311206E+00
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5292783714E+05
 Wavefunction value for orbital         1 :  0.8178487031E-05
 Average local ionization energy (ALIE):  0.1417612746E+02
 Delta-g (under promolecular approximation):  0.5860607837E-01
 Delta-g (under Hirshfeld partition):  0.8449217268E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1134000968E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.7912195031E-10 -0.3867410180E-10 -0.3173750915E-10
 Norm of gradient is:  0.9361217153E-10
 
 Components of Laplacian in x/y/z are:
 -0.7386350245E+06 -0.7386437236E+06 -0.7386367073E+06
 Total: -0.2215915455E+07
 
 Hessian matrix:
 -0.7386350245E+06 -0.2313382900E+01  0.6421825451E+00
 -0.2313382900E+01 -0.7386437236E+06 -0.3625553985E+01
  0.6421825451E+00 -0.3625553985E+01 -0.7386367073E+06
 Eigenvalues of Hessian: -0.7386456012E+06 -0.7386364166E+06 -0.7386334376E+06
 Eigenvectors(columns) of Hessian:
 -0.1783825678E+00 -0.6346355636E+00  0.7519423920E+00
 -0.9155984945E+00 -0.1728157282E+00 -0.3630621448E+00
 -0.3603596209E+00  0.7532412797E+00  0.5502440532E+00
 Determinant of Hessian: -0.4029914161E+18
 Ellipticity of electron density:    0.000012
 eta index:   -1.000016
 
 ----------------   CP    41,     Type (3,-3)   ----------------
 Corresponding nucleus:    63(N )
 Position (Bohr):       -8.752354271189   -1.313959182858    1.038886872769
 Position (Angstrom):   -4.631546422063   -0.695317255625    0.549755257775
 Density of all electrons:  0.1981844184E+03
 Density of Alpha electrons:  0.9909220921E+02
 Density of Beta electrons:  0.9909220921E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2872846554E+02
 G(r) in X,Y,Z:  0.1099071666E+02  0.8655276663E+01  0.9082472216E+01
 Hamiltonian kinetic energy K(r):  0.5531636600E+06
 Potential energy density V(r): -0.5531923885E+06
 Energy density E(r) or H(r): -0.5531636600E+06
 Laplacian of electron density: -0.2212539726E+07
 Electron localization function (ELF):  0.9999977941E+00
 Localized orbital locator (LOL):  0.9985169694E+00
 Local information entropy:  0.3643658247E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1981844184E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931721057E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1510778875E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1975809354E+05
 Wavefunction value for orbital         1 :  0.2126035661E-04
 Average local ionization energy (ALIE):  0.1425240769E+02
 Delta-g (under promolecular approximation):  0.4893981734E-01
 Delta-g (under Hirshfeld partition):  0.7285200248E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5446690691E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5858022444E-09 -0.4999734394E-10  0.1233832047E-11
 Norm of gradient is:  0.5879332669E-09
 
 Components of Laplacian in x/y/z are:
 -0.7375071310E+06 -0.7375171218E+06 -0.7375154733E+06
 Total: -0.2212539726E+07
 
 Hessian matrix:
 -0.7375071310E+06 -0.2049258868E+01  0.4995716948E+01
 -0.2049258868E+01 -0.7375171218E+06 -0.8361340704E+00
  0.4995716948E+01 -0.8361340704E+00 -0.7375154733E+06
 Eigenvalues of Hessian: -0.7375178455E+06 -0.7375174710E+06 -0.7375044096E+06
 Eigenvectors(columns) of Hessian:
 -0.4496908737E+00  0.1818146141E-01  0.8929991895E+00
 -0.3023128794E+00  0.9376852425E+00 -0.1713280737E+00
  0.8404671564E+00  0.3470098275E+00  0.4161720061E+00
 Determinant of Hessian: -0.4011524670E+18
 Ellipticity of electron density:    0.000001
 eta index:   -1.000018
 
 ----------------   CP    42,     Type (3,-3)   ----------------
 Corresponding nucleus:    87(H )
 Position (Bohr):        3.628554534087   -1.968360521065    3.710906135625
 Position (Angstrom):    1.920148367957   -1.041611530589    1.963726958773
 Density of all electrons:  0.4187582160E+00
 Density of Alpha electrons:  0.2093791080E+00
 Density of Beta electrons:  0.2093791080E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1505788130E-01
 G(r) in X,Y,Z:  0.3448060857E-02  0.3965109469E-02  0.7644710977E-02
 Hamiltonian kinetic energy K(r):  0.6058296213E+01
 Potential energy density V(r): -0.6073354095E+01
 Energy density E(r) or H(r): -0.6058296213E+01
 Laplacian of electron density: -0.2417295333E+02
 Electron localization function (ELF):  0.9994989608E+00
 Localized orbital locator (LOL):  0.9781150124E+00
 Local information entropy:  0.6234742526E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4187582160E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3002955566E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.7965077163E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3465470385E+00
 Wavefunction value for orbital         1 : -0.2760821241E-07
 Average local ionization energy (ALIE):  0.6712564439E+00
 Delta-g (under promolecular approximation):  0.1800697279E+00
 Delta-g (under Hirshfeld partition):  0.3016807465E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7864295240E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1794283445E-14  0.4294939851E-15 -0.2817570396E-16
 Norm of gradient is:  0.1845186179E-14
 
 Components of Laplacian in x/y/z are:
 -0.8190063243E+01 -0.7735009121E+01 -0.8247880965E+01
 Total: -0.2417295333E+02
 
 Hessian matrix:
 -0.8190063243E+01 -0.4414874446E+00 -0.2329480800E+00
 -0.4414874446E+00 -0.7735009121E+01  0.3737042926E+00
 -0.2329480800E+00  0.3737042926E+00 -0.8247880965E+01
 Eigenvalues of Hessian: -0.8460304533E+01 -0.8444663286E+01 -0.7267985510E+01
 Eigenvectors(columns) of Hessian:
 -0.8791733444E+00 -0.2019277525E-01 -0.4760740303E+00
 -0.4103826421E+00 -0.4756548955E+00  0.7780350297E+00
 -0.2421576297E+00  0.8794001775E+00  0.4098963408E+00
 Determinant of Hessian: -0.5192570317E+03
 Ellipticity of electron density:    0.001852
 eta index:   -1.164051
 
 ----------------   CP    43,     Type (3,-3)   ----------------
 Corresponding nucleus:    18(C )
 Position (Bohr):       -7.519791593471   -1.714019416908   -1.151864879296
 Position (Angstrom):   -3.979302342005   -0.907020014473   -0.609540644163
 Density of all electrons:  0.1221945984E+03
 Density of Alpha electrons:  0.6109729920E+02
 Density of Beta electrons:  0.6109729920E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8238035440E+01
 G(r) in X,Y,Z:  0.2473306559E+01  0.2943778308E+01  0.2820950573E+01
 Hamiltonian kinetic energy K(r):  0.2423057117E+06
 Potential energy density V(r): -0.2423139497E+06
 Energy density E(r) or H(r): -0.2423057117E+06
 Laplacian of electron density: -0.9691898946E+06
 Electron localization function (ELF):  0.9999990908E+00
 Localized orbital locator (LOL):  0.9990473768E+00
 Local information entropy:  0.3498504210E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221945984E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213966115E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.9231744200E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9890190398E+04
 Wavefunction value for orbital         1 :  0.1044927539E-04
 Average local ionization energy (ALIE):  0.1032746193E+02
 Delta-g (under promolecular approximation):  0.5273043447E-01
 Delta-g (under Hirshfeld partition):  0.6691912546E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6452701127E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.7065122500E-10 -0.1615281390E-10  0.3040363282E-10
 Norm of gradient is:  0.7859319232E-10
 
 Components of Laplacian in x/y/z are:
 -0.3230641813E+06 -0.3230626402E+06 -0.3230630731E+06
 Total: -0.9691898946E+06
 
 Hessian matrix:
 -0.3230641813E+06  0.7482577143E+00 -0.9699641768E+00
  0.7482577143E+00 -0.3230626402E+06  0.2674405294E+00
 -0.9699641768E+00  0.2674405294E+00 -0.3230630731E+06
 Eigenvalues of Hessian: -0.3230650035E+06 -0.3230625966E+06 -0.3230622944E+06
 Eigenvectors(columns) of Hessian:
 -0.8298785605E+00  0.2641473915E+00  0.4914547084E+00
  0.3148763712E+00 -0.5054295701E+00  0.8033640648E+00
 -0.4606022641E+00 -0.8214420888E+00 -0.3362713919E+00
 Determinant of Hessian: -0.3371808239E+17
 Ellipticity of electron density:    0.000007
 eta index:   -1.000008
 
 ----------------   CP    44,     Type (3,-3)   ----------------
 Corresponding nucleus:    16(C )
 Position (Bohr):        7.897250782006   -3.334026594445   -0.535285502601
 Position (Angstrom):    4.179045142623   -1.764290894325   -0.283260889303
 Density of all electrons:  0.1221837664E+03
 Density of Alpha electrons:  0.6109188319E+02
 Density of Beta electrons:  0.6109188319E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8611246369E+01
 G(r) in X,Y,Z:  0.3251408063E+01  0.2844168606E+01  0.2515669700E+01
 Hamiltonian kinetic energy K(r):  0.2422697522E+06
 Potential energy density V(r): -0.2422783634E+06
 Energy density E(r) or H(r): -0.2422697522E+06
 Laplacian of electron density: -0.9690445638E+06
 Electron localization function (ELF):  0.9999990062E+00
 Localized orbital locator (LOL):  0.9990041158E+00
 Local information entropy:  0.3498423565E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221837664E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213948221E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3412791430E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8978368508E+04
 Wavefunction value for orbital         1 : -0.5107327323E-06
 Average local ionization energy (ALIE):  0.1024908988E+02
 Delta-g (under promolecular approximation):  0.4030029397E-01
 Delta-g (under Hirshfeld partition):  0.5223812940E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.2839051278E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3833687708E-11 -0.4447194696E-10  0.1510901820E-10
 Norm of gradient is:  0.4712466083E-10
 
 Components of Laplacian in x/y/z are:
 -0.3230135871E+06 -0.3230151006E+06 -0.3230158761E+06
 Total: -0.9690445638E+06
 
 Hessian matrix:
 -0.3230135871E+06  0.4738310503E+00 -0.1501569463E+00
  0.4738310503E+00 -0.3230151006E+06 -0.3057511983E+00
 -0.1501569463E+00 -0.3057511983E+00 -0.3230158761E+06
 Eigenvalues of Hessian: -0.3230159823E+06 -0.3230151522E+06 -0.3230134293E+06
 Eigenvectors(columns) of Hessian:
 -0.6241446318E-02 -0.3025429043E+00  0.9531153316E+00
  0.3306213638E+00  0.8989064784E+00  0.2875007075E+00
  0.9437428453E+00 -0.3169147111E+00 -0.9441667111E-01
 Determinant of Hessian: -0.3370291651E+17
 Ellipticity of electron density:    0.000003
 eta index:   -1.000008
 
 ----------------   CP    45,     Type (3,-3)   ----------------
 Corresponding nucleus:    61(N )
 Position (Bohr):       -5.041475282256   -2.567127502872   -5.513462725905
 Position (Angstrom):   -2.667833828701   -1.358465372002   -2.917598827712
 Density of all electrons:  0.1987207771E+03
 Density of Alpha electrons:  0.9936038857E+02
 Density of Beta electrons:  0.9936038857E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2767489411E+02
 G(r) in X,Y,Z:  0.9186302609E+01  0.8258128260E+01  0.1023046324E+02
 Hamiltonian kinetic energy K(r):  0.5547427602E+06
 Potential energy density V(r): -0.5547704351E+06
 Energy density E(r) or H(r): -0.5547427602E+06
 Laplacian of electron density: -0.2218860341E+07
 Electron localization function (ELF):  0.9999979713E+00
 Localized orbital locator (LOL):  0.9985776916E+00
 Local information entropy:  0.3642140409E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1987207771E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931535730E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1432851098E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2235171237E+05
 Wavefunction value for orbital         1 :  0.7227768759E-04
 Average local ionization energy (ALIE):  0.1418064951E+02
 Delta-g (under promolecular approximation):  0.6114764155E-01
 Delta-g (under Hirshfeld partition):  0.8785912562E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.9974409375E+06
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.7303264764E-10 -0.1397015706E-10 -0.3094702619E-10
 Norm of gradient is:  0.8053975006E-10
 
 Components of Laplacian in x/y/z are:
 -0.7396201664E+06 -0.7396247714E+06 -0.7396154033E+06
 Total: -0.2218860341E+07
 
 Hessian matrix:
 -0.7396201664E+06 -0.1579688074E+01 -0.4342711547E+01
 -0.1579688074E+01 -0.7396247714E+06  0.1101716494E+01
 -0.4342711547E+01  0.1101716494E+01 -0.7396154033E+06
 Eigenvalues of Hessian: -0.7396252699E+06 -0.7396224925E+06 -0.7396125787E+06
 Eigenvectors(columns) of Hessian:
 -0.3241897963E+00 -0.7942442917E+00 -0.5138842098E+00
 -0.9452626977E+00  0.2933035904E+00  0.1430085175E+00
 -0.3714038512E-01 -0.5321174767E+00  0.8458555331E+00
 Determinant of Hessian: -0.4046002431E+18
 Ellipticity of electron density:    0.000004
 eta index:   -1.000017
 
 ----------------   CP    46,     Type (3,-3)   ----------------
 Corresponding nucleus:    65(N )
 Position (Bohr):        2.760393824946   -0.510087453332    4.489782735834
 Position (Angstrom):    1.460737505279   -0.269926655871    2.375890705709
 Density of all electrons:  0.1982045629E+03
 Density of Alpha electrons:  0.9910228143E+02
 Density of Beta electrons:  0.9910228143E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2898242740E+02
 G(r) in X,Y,Z:  0.8618321380E+01  0.9374717886E+01  0.1098938813E+02
 Hamiltonian kinetic energy K(r):  0.5531855335E+06
 Potential energy density V(r): -0.5532145159E+06
 Energy density E(r) or H(r): -0.5531855335E+06
 Laplacian of electron density: -0.2212626204E+07
 Electron localization function (ELF):  0.9999977557E+00
 Localized orbital locator (LOL):  0.9985041319E+00
 Local information entropy:  0.3643601796E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1982045629E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931669106E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1100751918E-02
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3325246171E+05
 Wavefunction value for orbital         1 :  0.2380191796E-05
 Average local ionization energy (ALIE):  0.1422863873E+02
 Delta-g (under promolecular approximation):  0.5503739740E-01
 Delta-g (under Hirshfeld partition):  0.8086725414E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.2596839949E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3938695328E-10 -0.4911567355E-11  0.2561165101E-09
 Norm of gradient is:  0.2591739229E-09
 
 Components of Laplacian in x/y/z are:
 -0.7375466840E+06 -0.7375434700E+06 -0.7375360501E+06
 Total: -0.2212626204E+07
 
 Hessian matrix:
 -0.7375466840E+06  0.7440194980E+00 -0.1004494428E+01
  0.7440194980E+00 -0.7375434700E+06 -0.2923161394E+01
 -0.1004494428E+01 -0.2923161394E+01 -0.7375360501E+06
 Eigenvalues of Hessian: -0.7375468631E+06 -0.7375444252E+06 -0.7375349158E+06
 Eigenvectors(columns) of Hessian:
 -0.9830081055E+00  0.1533031739E+00 -0.1009613861E+00
  0.1784352499E+00  0.9271193164E+00 -0.3295612760E+00
 -0.4308046166E-01  0.3419764757E+00  0.9387204929E+00
 Determinant of Hessian: -0.4011995065E+18
 Ellipticity of electron density:    0.000003
 eta index:   -1.000016
 
 ----------------   CP    47,     Type (3,-3)   ----------------
 Corresponding nucleus:    38(O )
 Position (Bohr):       15.330041843011   -3.505533666020   -1.504028486997
 Position (Angstrom):    8.112308785511   -1.855048528111   -0.795897599868
 Density of all electrons:  0.3021562900E+03
 Density of Alpha electrons:  0.1510781450E+03
 Density of Beta electrons:  0.1510781450E+03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7361613042E+02
 G(r) in X,Y,Z:  0.2217443113E+02  0.2466035341E+02  0.2678134588E+02
 Hamiltonian kinetic energy K(r):  0.1129081380E+07
 Potential energy density V(r): -0.1129154996E+07
 Energy density E(r) or H(r): -0.1129081380E+07
 Laplacian of electron density: -0.4516031056E+07
 Electron localization function (ELF):  0.9999964489E+00
 Localized orbital locator (LOL):  0.9981190928E+00
 Local information entropy:  0.2855342279E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3021562900E+03
 Sign(lambda2)*rho with promolecular approximation: -0.2923660618E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6121187916E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2274880840E+05
 Wavefunction value for orbital         1 :  0.2416441282E-05
 Average local ionization energy (ALIE):  0.1871762253E+02
 Delta-g (under promolecular approximation):  0.4301587812E-01
 Delta-g (under Hirshfeld partition):  0.6780610704E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1581233336E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.6235518862E-09  0.5225574290E-10 -0.4778092231E-10
 Norm of gradient is:  0.6275592673E-09
 
 Components of Laplacian in x/y/z are:
 -0.1505352821E+07 -0.1505343239E+07 -0.1505334996E+07
 Total: -0.4516031056E+07
 
 Hessian matrix:
 -0.1505352821E+07  0.1022577224E+02  0.3396633835E+01
  0.1022577224E+02 -0.1505343239E+07 -0.1886475743E+01
  0.3396633835E+01 -0.1886475743E+01 -0.1505334996E+07
 Eigenvalues of Hessian: -0.1505359926E+07 -0.1505336759E+07 -0.1505334371E+07
 Eigenvectors(columns) of Hessian:
 -0.8346613745E+00  0.5203743608E+00  0.1804187198E+00
  0.5288698465E+00  0.8487021019E+00 -0.1194891077E-02
  0.1537435374E+00 -0.9442069122E-01  0.9835891712E+00
 Determinant of Hessian: -0.3411198526E+19
 Ellipticity of electron density:    0.000015
 eta index:   -1.000017
 
 ----------------   CP    48,     Type (3,-3)   ----------------
 Corresponding nucleus:    74(C )
 Position (Bohr):        0.313983953488   -0.160790723464    3.848935995381
 Position (Angstrom):    0.166153152775   -0.085086786582    2.036769214980
 Density of all electrons:  0.1221802780E+03
 Density of Alpha electrons:  0.6109013901E+02
 Density of Beta electrons:  0.6109013901E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8200668802E+01
 G(r) in X,Y,Z:  0.2956173019E+01  0.2973278817E+01  0.2271216967E+01
 Hamiltonian kinetic energy K(r):  0.2422776813E+06
 Potential energy density V(r): -0.2422858820E+06
 Energy density E(r) or H(r): -0.2422776813E+06
 Laplacian of electron density: -0.9690779226E+06
 Electron localization function (ELF):  0.9999990987E+00
 Localized orbital locator (LOL):  0.9990515086E+00
 Local information entropy:  0.3498397589E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221802780E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213976551E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3475690422E-02
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1995224352E+05
 Wavefunction value for orbital         1 : -0.6251554204E-05
 Average local ionization energy (ALIE):  0.1033728439E+02
 Delta-g (under promolecular approximation):  0.5369203219E-01
 Delta-g (under Hirshfeld partition):  0.6800037067E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.9370811032E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.8736315707E-12 -0.1166778046E-11 -0.2268176098E-11
 Norm of gradient is:  0.2696150208E-11
 
 Components of Laplacian in x/y/z are:
 -0.3230252487E+06 -0.3230251575E+06 -0.3230275164E+06
 Total: -0.9690779226E+06
 
 Hessian matrix:
 -0.3230252487E+06 -0.3025455209E-01  0.5218129131E+00
 -0.3025455209E-01 -0.3230251575E+06  0.1003257883E+01
  0.5218129131E+00  0.1003257883E+01 -0.3230275164E+06
 Eigenvalues of Hessian: -0.3230279773E+06 -0.3230252098E+06 -0.3230247355E+06
 Eigenvectors(columns) of Hessian:
 -0.1807588750E+00  0.9266226880E+00  0.3296917093E+00
 -0.3314002360E+00 -0.3729939063E+00  0.8666310804E+00
  0.9260130197E+00  0.4739134888E-01  0.3745049364E+00
 Determinant of Hessian: -0.3370639724E+17
 Ellipticity of electron density:    0.000009
 eta index:   -1.000010
 
 ----------------   CP    49,     Type (3,-3)   ----------------
 Corresponding nucleus:    56(H )
 Position (Bohr):      -10.050988696890    1.210850309452    3.718606974571
 Position (Angstrom):   -5.318754165438    0.640754389577    1.967802067248
 Density of all electrons:  0.4421457772E+00
 Density of Alpha electrons:  0.2210728886E+00
 Density of Beta electrons:  0.2210728886E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6125333045E-02
 G(r) in X,Y,Z:  0.2082510387E-02  0.2110493390E-02  0.1932329268E-02
 Hamiltonian kinetic energy K(r):  0.6634374368E+01
 Potential energy density V(r): -0.6640499701E+01
 Energy density E(r) or H(r): -0.6634374368E+01
 Laplacian of electron density: -0.2651299614E+02
 Electron localization function (ELF):  0.9999306642E+00
 Localized orbital locator (LOL):  0.9917550178E+00
 Local information entropy:  0.6532043098E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4421457772E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2977287015E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2072039445E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1956267099E+00
 Wavefunction value for orbital         1 : -0.7044459461E-05
 Average local ionization energy (ALIE):  0.5346077248E+00
 Delta-g (under promolecular approximation):  0.1135556394E+00
 Delta-g (under Hirshfeld partition):  0.2018558990E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7819886869E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3978083037E-14 -0.9151926297E-15  0.5185837459E-15
 Norm of gradient is:  0.4114808781E-14
 
 Components of Laplacian in x/y/z are:
 -0.8720221853E+01 -0.9082835349E+01 -0.8709938938E+01
 Total: -0.2651299614E+02
 
 Hessian matrix:
 -0.8720221853E+01 -0.2329614366E-01 -0.3667829030E+00
 -0.2329614366E-01 -0.9082835349E+01  0.2073896527E-01
 -0.3667829030E+00  0.2073896527E-01 -0.8709938938E+01
 Eigenvalues of Hessian: -0.9085342251E+01 -0.9080708817E+01 -0.8346945071E+01
 Eigenvectors(columns) of Hessian:
 -0.3864662712E+00 -0.5986784688E+00 -0.7015895611E+00
 -0.8612405141E+00  0.5064376784E+00  0.4225700885E-01
 -0.3300130272E+00 -0.6205682629E+00  0.7113272334E+00
 Determinant of Hessian: -0.6886342158E+03
 Ellipticity of electron density:    0.000510
 eta index:   -1.088463
 
 ----------------   CP    50,     Type (3,-3)   ----------------
 Corresponding nucleus:    26(C )
 Position (Bohr):       -8.623485520784    1.157786532004    2.283416859624
 Position (Angstrom):   -4.563352016151    0.612674247827    1.208332165104
 Density of all electrons:  0.1220263905E+03
 Density of Alpha electrons:  0.6101319526E+02
 Density of Beta electrons:  0.6101319526E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8654364948E+01
 G(r) in X,Y,Z:  0.3157948360E+01  0.2489742564E+01  0.3006674024E+01
 Hamiltonian kinetic energy K(r):  0.2419324400E+06
 Potential energy density V(r): -0.2419410944E+06
 Energy density E(r) or H(r): -0.2419324400E+06
 Laplacian of electron density: -0.9676951426E+06
 Electron localization function (ELF):  0.9999989919E+00
 Localized orbital locator (LOL):  0.9989969840E+00
 Local information entropy:  0.3497249590E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1220263905E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213897957E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5795224278E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8560586859E+04
 Wavefunction value for orbital         1 : -0.4444194645E-05
 Average local ionization energy (ALIE):  0.1023162371E+02
 Delta-g (under promolecular approximation):  0.4082544938E-01
 Delta-g (under Hirshfeld partition):  0.5359280866E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1636596062E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1745737394E-09  0.1395875672E-10 -0.1176268937E-10
 Norm of gradient is:  0.1755254917E-09
 
 Components of Laplacian in x/y/z are:
 -0.3225640125E+06 -0.3225665466E+06 -0.3225645835E+06
 Total: -0.9676951426E+06
 
 Hessian matrix:
 -0.3225640125E+06 -0.2828610606E-01 -0.1526448392E+00
 -0.2828610606E-01 -0.3225665466E+06 -0.1518066746E+01
 -0.1526448392E+00 -0.1518066746E+01 -0.3225645835E+06
 Eigenvalues of Hessian: -0.3225673756E+06 -0.3225640579E+06 -0.3225637090E+06
 Eigenvectors(columns) of Hessian:
 -0.2910678632E-01  0.9278022985E+00 -0.3719350614E+00
 -0.8775012631E+00 -0.2019099589E+00 -0.4349987377E+00
 -0.4786902216E+00  0.3137120709E+00  0.8200246389E+00
 Determinant of Hessian: -0.3356231577E+17
 Ellipticity of electron density:    0.000010
 eta index:   -1.000011
 
 ----------------   CP    51,     Type (3,-3)   ----------------
 Corresponding nucleus:    40(H )
 Position (Bohr):        2.423242694938   -1.506311055154   -3.502114125400
 Position (Angstrom):    1.282324810648   -0.797105482919   -1.853238985143
 Density of all electrons:  0.3745578681E+00
 Density of Alpha electrons:  0.1872789341E+00
 Density of Beta electrons:  0.1872789341E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2747420211E-01
 G(r) in X,Y,Z:  0.1075536963E-01  0.6206640779E-02  0.1051219170E-01
 Hamiltonian kinetic energy K(r):  0.5173408752E+01
 Potential energy density V(r): -0.5200882954E+01
 Energy density E(r) or H(r): -0.5173408752E+01
 Laplacian of electron density: -0.2058373820E+02
 Electron localization function (ELF):  0.9975868551E+00
 Localized orbital locator (LOL):  0.9531386934E+00
 Local information entropy:  0.5665178195E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3745578681E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2910406368E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2010744198E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3626074355E+00
 Wavefunction value for orbital         1 : -0.5417358882E-05
 Average local ionization energy (ALIE):  0.7325208224E+00
 Delta-g (under promolecular approximation):  0.2097891588E+00
 Delta-g (under Hirshfeld partition):  0.3176968697E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7591001516E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.7187311727E-15  0.2589887940E-15  0.9466846794E-15
 Norm of gradient is:  0.1216495613E-14
 
 Components of Laplacian in x/y/z are:
 -0.6540841957E+01 -0.6781092980E+01 -0.7261803262E+01
 Total: -0.2058373820E+02
 
 Hessian matrix:
 -0.6540841957E+01 -0.6618500138E+00  0.2313719094E+00
 -0.6618500138E+00 -0.6781092980E+01 -0.1976910351E+00
  0.2313719094E+00 -0.1976910351E+00 -0.7261803262E+01
 Eigenvalues of Hessian: -0.7335887000E+01 -0.7328526070E+01 -0.5919325129E+01
 Eigenvectors(columns) of Hessian:
  0.4400829472E+00  0.4963440055E+00 -0.7483111838E+00
  0.7174300847E+00  0.3068141954E+00  0.6254271524E+00
  0.5400195118E+00 -0.8121007805E+00 -0.2210684265E+00
 Determinant of Hessian: -0.3182302537E+03
 Ellipticity of electron density:    0.001004
 eta index:   -1.239311
 
 ----------------   CP    52,     Type (3,-3)   ----------------
 Corresponding nucleus:    55(H )
 Position (Bohr):       -6.802677028814    1.450359782587    3.148365225723
 Position (Angstrom):   -3.599821656782    0.767497344555    1.666043129052
 Density of all electrons:  0.4405162929E+00
 Density of Alpha electrons:  0.2202581464E+00
 Density of Beta electrons:  0.2202581464E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6255829136E-02
 G(r) in X,Y,Z:  0.1688693848E-02  0.2085584686E-02  0.2481550603E-02
 Hamiltonian kinetic energy K(r):  0.6637576480E+01
 Potential energy density V(r): -0.6643832309E+01
 Energy density E(r) or H(r): -0.6637576480E+01
 Laplacian of electron density: -0.2652528260E+02
 Electron localization function (ELF):  0.9999267881E+00
 Localized orbital locator (LOL):  0.9915293145E+00
 Local information entropy:  0.6511415830E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4405162929E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2974022307E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3452729031E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2764681297E+00
 Wavefunction value for orbital         1 : -0.1537839074E-05
 Average local ionization energy (ALIE):  0.5247283114E+00
 Delta-g (under promolecular approximation):  0.1105283427E+00
 Delta-g (under Hirshfeld partition):  0.1946681657E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8518759454E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3577018866E-14 -0.7859995647E-15  0.8574799340E-15
 Norm of gradient is:  0.3761400154E-14
 
 Components of Laplacian in x/y/z are:
 -0.8514925995E+01 -0.9063325602E+01 -0.8947031007E+01
 Total: -0.2652528260E+02
 
 Hessian matrix:
 -0.8514925995E+01  0.9826253390E-01  0.2688671958E+00
  0.9826253390E-01 -0.9063325602E+01  0.4452481479E-01
  0.2688671958E+00  0.4452481479E-01 -0.8947031007E+01
 Eigenvalues of Hessian: -0.9081096315E+01 -0.9074886774E+01 -0.8369299515E+01
 Eigenvectors(columns) of Hessian:
  0.3008221254E+00 -0.3392640808E+00 -0.8912945261E+00
 -0.9042740833E+00 -0.3983803582E+00 -0.1535626009E+00
 -0.3029759579E+00  0.8521695686E+00 -0.4266293418E+00
 Determinant of Hessian: -0.6897133105E+03
 Ellipticity of electron density:    0.000684
 eta index:   -1.085049
 
 ----------------   CP    53,     Type (3,-3)   ----------------
 Corresponding nucleus:    29(S )
 Position (Bohr):       13.018155163359   -1.907795641264   -1.086734261472
 Position (Angstrom):    6.888911040449   -1.009561976417   -0.575075005478
 Density of all electrons:  0.2570176027E+04
 Density of Alpha electrons:  0.1285088013E+04
 Density of Beta electrons:  0.1285088013E+04
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.9710654901E+04
 G(r) in X,Y,Z:  0.3236373705E+04  0.3236933229E+04  0.3237347967E+04
 Hamiltonian kinetic energy K(r):  0.2868684617E+08
 Potential energy density V(r): -0.2869655682E+08
 Energy density E(r) or H(r): -0.2868684617E+08
 Laplacian of electron density: -0.1147085420E+09
 Electron localization function (ELF):  0.9999508192E+00
 Localized orbital locator (LOL):  0.9930357657E+00
 Local information entropy: -0.9228405882E+01
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2570176027E+04
 Sign(lambda2)*rho with promolecular approximation: -0.2661173065E+04
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1837704623E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6914262669E+06
 Wavefunction value for orbital         1 : -0.6810099090E-06
 Average local ionization energy (ALIE):  0.8381928450E+02
 Delta-g (under promolecular approximation):  0.2550925599E-01
 Delta-g (under Hirshfeld partition):  0.1539057419E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1981335016E+09
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.8013249704E-08  0.3086011185E-08 -0.1930561515E-08
 Norm of gradient is:  0.8801289884E-08
 
 Components of Laplacian in x/y/z are:
 -0.3823618288E+08 -0.3823618049E+08 -0.3823617867E+08
 Total: -0.1147085420E+09
 
 Hessian matrix:
 -0.3823618288E+08 -0.1997070993E+01  0.8794398384E+00
 -0.1997070993E+01 -0.3823618049E+08  0.4196425634E+00
  0.8794398384E+00  0.4196425634E+00 -0.3823617867E+08
 Eigenvalues of Hessian: -0.3823618418E+08 -0.3823617937E+08 -0.3823617850E+08
 Eigenvectors(columns) of Hessian:
 -0.8577961887E+00 -0.4779050750E+00  0.1891888950E+00
 -0.4837373526E+00  0.8750455773E+00  0.1712925521E-01
  0.1737350638E+00  0.7682432535E-01  0.9817912969E+00
 Determinant of Hessian: -0.5590150696E+23
 Ellipticity of electron density:    0.000000
 eta index:   -1.000000
 
 ----------------   CP    54,     Type (3,-3)   ----------------
 Corresponding nucleus:    60(N )
 Position (Bohr):       -6.160418889727    0.187227875685   -2.127991647133
 Position (Angstrom):   -3.259953286060    0.099076725058   -1.126084684655
 Density of all electrons:  0.1986586227E+03
 Density of Alpha electrons:  0.9932931137E+02
 Density of Beta electrons:  0.9932931137E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2786231163E+02
 G(r) in X,Y,Z:  0.8440038465E+01  0.1049329710E+02  0.8928976066E+01
 Hamiltonian kinetic energy K(r):  0.5545630487E+06
 Potential energy density V(r): -0.5545909110E+06
 Energy density E(r) or H(r): -0.5545630487E+06
 Laplacian of electron density: -0.2218140746E+07
 Electron localization function (ELF):  0.9999979416E+00
 Localized orbital locator (LOL):  0.9985673277E+00
 Local information entropy:  0.3642317872E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1986586227E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931539840E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1717853341E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2707150595E+05
 Wavefunction value for orbital         1 : -0.9497270877E-05
 Average local ionization energy (ALIE):  0.1417803155E+02
 Delta-g (under promolecular approximation):  0.6073666016E-01
 Delta-g (under Hirshfeld partition):  0.8729684768E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1003180308E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2989680864E-09  0.8535346041E-11 -0.7053353995E-10
 Norm of gradient is:  0.3072942386E-09
 
 Components of Laplacian in x/y/z are:
 -0.7393839758E+06 -0.7393747668E+06 -0.7393820030E+06
 Total: -0.2218140746E+07
 
 Hessian matrix:
 -0.7393839758E+06  0.1198329365E+00  0.1498820489E+01
  0.1198329365E+00 -0.7393747668E+06  0.4941835380E+01
  0.1498820489E+01  0.4941835380E+01 -0.7393820030E+06
 Eigenvalues of Hessian: -0.7393855713E+06 -0.7393829671E+06 -0.7393722072E+06
 Eigenvectors(columns) of Hessian:
 -0.6372280624E+00 -0.7677307544E+00  0.6730442207E-01
 -0.3147002368E+00  0.3389326488E+00  0.8866162758E+00
  0.7034942483E+00 -0.5437960540E+00  0.4575824453E+00
 Determinant of Hessian: -0.4042067247E+18
 Ellipticity of electron density:    0.000004
 eta index:   -1.000018
 
 ----------------   CP    55,     Type (3,-3)   ----------------
 Corresponding nucleus:    78(H )
 Position (Bohr):        3.880170466397    0.976434505750    4.752216600593
 Position (Angstrom):    2.053297785236    0.516706888382    2.514764726309
 Density of all electrons:  0.4044143302E+00
 Density of Alpha electrons:  0.2022071651E+00
 Density of Beta electrons:  0.2022071651E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1587726618E-01
 G(r) in X,Y,Z:  0.3747811075E-02  0.4022150512E-02  0.8107304590E-02
 Hamiltonian kinetic energy K(r):  0.5821848926E+01
 Potential energy density V(r): -0.5837726192E+01
 Energy density E(r) or H(r): -0.5821848926E+01
 Laplacian of electron density: -0.2322388664E+02
 Electron localization function (ELF):  0.9993744419E+00
 Localized orbital locator (LOL):  0.9756066747E+00
 Local information entropy:  0.6051044567E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4044143302E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2989391918E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4140396784E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2974900207E+00
 Wavefunction value for orbital         1 :  0.2028718728E-05
 Average local ionization energy (ALIE):  0.6688011917E+00
 Delta-g (under promolecular approximation):  0.1745522995E+00
 Delta-g (under Hirshfeld partition):  0.2861638800E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7750637286E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1393375127E-14 -0.1015194398E-15 -0.1393625320E-14
 Norm of gradient is:  0.1973320039E-14
 
 Components of Laplacian in x/y/z are:
 -0.7698569313E+01 -0.7422671210E+01 -0.8102646115E+01
 Total: -0.2322388664E+02
 
 Hessian matrix:
 -0.7698569313E+01  0.5617235266E+00  0.9904731844E-01
  0.5617235266E+00 -0.7422671210E+01  0.1225159646E+00
  0.9904731844E-01  0.1225159646E+00 -0.8102646115E+01
 Eigenvalues of Hessian: -0.8139393713E+01 -0.8124013474E+01 -0.6960479450E+01
 Eigenvectors(columns) of Hessian:
 -0.7904012673E+00  0.3687166570E-01  0.6114787951E+00
  0.5935936740E+00 -0.2005490603E+00  0.7793757917E+00
  0.1513683814E+00  0.9789895580E+00  0.1366274439E+00
 Determinant of Hessian: -0.4602585310E+03
 Ellipticity of electron density:    0.001893
 eta index:   -1.169373
 
 ----------------   CP    56,     Type (3,-3)   ----------------
 Corresponding nucleus:    17(C )
 Position (Bohr):       -4.934771722075   -0.330659686285   -4.258190687814
 Position (Angstrom):   -2.611368736331   -0.174977570546   -2.253337471671
 Density of all electrons:  0.1222063543E+03
 Density of Alpha electrons:  0.6110317713E+02
 Density of Beta electrons:  0.6110317713E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8230689674E+01
 G(r) in X,Y,Z:  0.2568928319E+01  0.2855773457E+01  0.2805987898E+01
 Hamiltonian kinetic energy K(r):  0.2423291254E+06
 Potential energy density V(r): -0.2423373561E+06
 Energy density E(r) or H(r): -0.2423291254E+06
 Laplacian of electron density: -0.9692835790E+06
 Electron localization function (ELF):  0.9999990927E+00
 Localized orbital locator (LOL):  0.9990483779E+00
 Local information entropy:  0.3498591711E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1222063543E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213962390E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5013355802E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1181869020E+05
 Wavefunction value for orbital         1 :  0.9952456430E-05
 Average local ionization energy (ALIE):  0.1032935142E+02
 Delta-g (under promolecular approximation):  0.5206927857E-01
 Delta-g (under Hirshfeld partition):  0.6617163987E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4604177482E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1309090752E-09 -0.3439283580E-11 -0.8606469704E-10
 Norm of gradient is:  0.1567040099E-09
 
 Components of Laplacian in x/y/z are:
 -0.3230950673E+06 -0.3230941885E+06 -0.3230943232E+06
 Total: -0.9692835790E+06
 
 Hessian matrix:
 -0.3230950673E+06  0.6686060023E+00 -0.1229893737E+01
  0.6686060023E+00 -0.3230941885E+06  0.7523458112E+00
 -0.1229893737E+01  0.7523458112E+00 -0.3230943232E+06
 Eigenvalues of Hessian: -0.3230964183E+06 -0.3230938353E+06 -0.3230933253E+06
 Eigenvectors(columns) of Hessian:
 -0.7168793867E+00  0.5467084671E+00  0.4326589846E+00
  0.4061519564E+00  0.8318712530E+00 -0.3781941389E+00
 -0.5666785095E+00 -0.9539428930E-01 -0.8183980672E+00
 Determinant of Hessian: -0.3372786117E+17
 Ellipticity of electron density:    0.000008
 eta index:   -1.000010
 
 ----------------   CP    57,     Type (3,-3)   ----------------
 Corresponding nucleus:    58(N )
 Position (Bohr):        7.266461853677   -0.724667919248   -0.557421309681
 Position (Angstrom):    3.845246016862   -0.383477748338   -0.294974653955
 Density of all electrons:  0.1990011769E+03
 Density of Alpha electrons:  0.9950058847E+02
 Density of Beta electrons:  0.9950058847E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2665081595E+02
 G(r) in X,Y,Z:  0.9057740132E+01  0.9941517253E+01  0.7651558564E+01
 Hamiltonian kinetic energy K(r):  0.5555797330E+06
 Potential energy density V(r): -0.5556063838E+06
 Energy density E(r) or H(r): -0.5555797330E+06
 Laplacian of electron density: -0.2222212329E+07
 Electron localization function (ELF):  0.9999981275E+00
 Localized orbital locator (LOL):  0.9986334612E+00
 Local information entropy:  0.3641334694E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1990011769E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931481409E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5174242756E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2414582859E+05
 Wavefunction value for orbital         1 : -0.2195917506E-05
 Average local ionization energy (ALIE):  0.1421604531E+02
 Delta-g (under promolecular approximation):  0.6432071202E-01
 Delta-g (under Hirshfeld partition):  0.9035646792E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8458765030E+06
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2917683525E-09  0.1376139480E-10  0.3908928736E-10
 Norm of gradient is:  0.2946966575E-09
 
 Components of Laplacian in x/y/z are:
 -0.7407367483E+06 -0.7407331860E+06 -0.7407423945E+06
 Total: -0.2222212329E+07
 
 Hessian matrix:
 -0.7407367483E+06  0.6670886470E+01  0.4560028252E+01
  0.6670886470E+01 -0.7407331860E+06  0.4495354224E+01
  0.4560028252E+01  0.4495354224E+01 -0.7407423945E+06
 Eigenvalues of Hessian: -0.7407450134E+06 -0.7407416627E+06 -0.7407256527E+06
 Eigenvectors(columns) of Hessian:
  0.4073970596E+00  0.7016663579E+00 -0.5845442310E+00
  0.1145855551E+00 -0.6742846906E+00 -0.7295274543E+00
 -0.9060340978E+00  0.2302270146E+00 -0.3551024294E+00
 Determinant of Hessian: -0.4064366789E+18
 Ellipticity of electron density:    0.000005
 eta index:   -1.000026
 
 ----------------   CP    58,     Type (3,-3)   ----------------
 Corresponding nucleus:    57(N )
 Position (Bohr):        5.106491865814   -0.340593513767   -1.449993248166
 Position (Angstrom):    2.702239123050   -0.180234325667   -0.767303382893
 Density of all electrons:  0.1988678950E+03
 Density of Alpha electrons:  0.9943394750E+02
 Density of Beta electrons:  0.9943394750E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2715599015E+02
 G(r) in X,Y,Z:  0.8954040452E+01  0.1030871633E+02  0.7893233366E+01
 Hamiltonian kinetic energy K(r):  0.5551851484E+06
 Potential energy density V(r): -0.5552123044E+06
 Energy density E(r) or H(r): -0.5551851484E+06
 Laplacian of electron density: -0.2220631970E+07
 Electron localization function (ELF):  0.9999980515E+00
 Localized orbital locator (LOL):  0.9986060406E+00
 Local information entropy:  0.3641718718E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1988678950E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931528623E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1693537619E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3322108734E+05
 Wavefunction value for orbital         1 :  0.4225936200E-05
 Average local ionization energy (ALIE):  0.1423102462E+02
 Delta-g (under promolecular approximation):  0.6357798212E-01
 Delta-g (under Hirshfeld partition):  0.8983573672E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.9801929194E+06
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1811861911E-09 -0.1807149569E-10  0.7275049660E-10
 Norm of gradient is:  0.1960807220E-09
 
 Components of Laplacian in x/y/z are:
 -0.7402113990E+06 -0.7402054228E+06 -0.7402151479E+06
 Total: -0.2220631970E+07
 
 Hessian matrix:
 -0.7402113990E+06  0.5648593392E+01  0.4713041991E+01
  0.5648593392E+01 -0.7402054228E+06  0.5531132172E+01
  0.4713041991E+01  0.5531132172E+01 -0.7402151479E+06
 Eigenvalues of Hessian: -0.7402186134E+06 -0.7402145068E+06 -0.7401988495E+06
 Eigenvectors(columns) of Hessian:
  0.4315995754E+00  0.7525813782E+00 -0.4973359786E+00
  0.1853620807E+00 -0.6135560431E+00 -0.7675870511E+00
 -0.8828152160E+00  0.2391030135E+00 -0.4043105778E+00
 Determinant of Hessian: -0.4055701650E+18
 Ellipticity of electron density:    0.000006
 eta index:   -1.000027
 
 ----------------   CP    59,     Type (3,-3)   ----------------
 Corresponding nucleus:    66(N )
 Position (Bohr):       -0.824308851692    1.998557303637    4.514150340874
 Position (Angstrom):   -0.436205459061    1.057590979769    2.388785486980
 Density of all electrons:  0.1982099261E+03
 Density of Alpha electrons:  0.9910496305E+02
 Density of Beta electrons:  0.9910496305E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2890560780E+02
 G(r) in X,Y,Z:  0.9105724808E+01  0.8915168396E+01  0.1088471460E+02
 Hamiltonian kinetic energy K(r):  0.5532193578E+06
 Potential energy density V(r): -0.5532482634E+06
 Energy density E(r) or H(r): -0.5532193578E+06
 Laplacian of electron density: -0.2212761809E+07
 Electron localization function (ELF):  0.9999977678E+00
 Localized orbital locator (LOL):  0.9985081581E+00
 Local information entropy:  0.3643586759E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1982099261E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931713107E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.7266891577E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3518114193E+05
 Wavefunction value for orbital         1 : -0.3369733117E-05
 Average local ionization energy (ALIE):  0.1423507523E+02
 Delta-g (under promolecular approximation):  0.5086496462E-01
 Delta-g (under Hirshfeld partition):  0.7531592308E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4977903290E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.5439658164E-11 -0.1897839718E-10  0.3042548583E-09
 Norm of gradient is:  0.3048947167E-09
 
 Components of Laplacian in x/y/z are:
 -0.7375896532E+06 -0.7375904167E+06 -0.7375817388E+06
 Total: -0.2212761809E+07
 
 Hessian matrix:
 -0.7375896532E+06  0.1244710474E+01 -0.2567431843E+01
  0.1244710474E+01 -0.7375904167E+06 -0.3800070456E+01
 -0.2567431843E+01 -0.3800070456E+01 -0.7375817388E+06
 Eigenvalues of Hessian: -0.7375918899E+06 -0.7375904053E+06 -0.7375795135E+06
 Eigenvectors(columns) of Hessian:
 -0.1673038296E+00  0.9482284841E+00 -0.2699484592E+00
  0.9364761218E+00  0.6723328989E-01 -0.3442268990E+00
  0.3082562276E+00  0.3103907646E+00  0.8992417202E+00
 Determinant of Hessian: -0.4012732756E+18
 Ellipticity of electron density:    0.000002
 eta index:   -1.000017
 
 ----------------   CP    60,     Type (3,-3)   ----------------
 Corresponding nucleus:    36(O )
 Position (Bohr):        1.048411033223   -0.394068265571   -3.916402984334
 Position (Angstrom):    0.554795226441   -0.208531945680   -2.072471208022
 Density of all electrons:  0.3017692223E+03
 Density of Alpha electrons:  0.1508846111E+03
 Density of Beta electrons:  0.1508846111E+03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7528482132E+02
 G(r) in X,Y,Z:  0.2674913889E+02  0.2139554096E+02  0.2714014147E+02
 Hamiltonian kinetic energy K(r):  0.1127582575E+07
 Potential energy density V(r): -0.1127657860E+07
 Energy density E(r) or H(r): -0.1127582575E+07
 Laplacian of electron density: -0.4510029162E+07
 Electron localization function (ELF):  0.9999962701E+00
 Localized orbital locator (LOL):  0.9980724337E+00
 Local information entropy:  0.2859879866E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3017692223E+03
 Sign(lambda2)*rho with promolecular approximation: -0.2923746647E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2109469571E-02
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8810719527E+05
 Wavefunction value for orbital         1 : -0.1028234364E-05
 Average local ionization energy (ALIE):  0.1880666541E+02
 Delta-g (under promolecular approximation):  0.5547021900E-01
 Delta-g (under Hirshfeld partition):  0.8890504810E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1390408739E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.7516975237E-10  0.3162626411E-11 -0.5684328008E-11
 Norm of gradient is:  0.7545068231E-10
 
 Components of Laplacian in x/y/z are:
 -0.1503335944E+07 -0.1503358779E+07 -0.1503334439E+07
 Total: -0.4510029162E+07
 
 Hessian matrix:
 -0.1503335944E+07  0.5605161780E+01 -0.2914046157E+01
  0.5605161780E+01 -0.1503358779E+07 -0.7710703640E+01
 -0.2914046157E+01 -0.7710703640E+01 -0.1503334439E+07
 Eigenvalues of Hessian: -0.1503361843E+07 -0.1503338199E+07 -0.1503329120E+07
 Eigenvectors(columns) of Hessian:
  0.1780272271E+00  0.7983606034E+00  0.5752622475E+00
 -0.9520153463E+00 -0.8156698901E-02  0.3059415773E+00
 -0.2489439432E+00  0.6021244184E+00 -0.7585994318E+00
 Determinant of Hessian: -0.3397615943E+19
 Ellipticity of electron density:    0.000016
 eta index:   -1.000022
 
 ----------------   CP    61,     Type (3,-3)   ----------------
 Corresponding nucleus:    37(O )
 Position (Bohr):       13.180939630535   -0.394619071091    1.309528713765
 Position (Angstrom):    6.975052870767   -0.208823419409    0.692972752347
 Density of all electrons:  0.3021729103E+03
 Density of Alpha electrons:  0.1510864552E+03
 Density of Beta electrons:  0.1510864552E+03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7357244285E+02
 G(r) in X,Y,Z:  0.2658843286E+02  0.2490002243E+02  0.2208398757E+02
 Hamiltonian kinetic energy K(r):  0.1129147996E+07
 Potential energy density V(r): -0.1129221568E+07
 Energy density E(r) or H(r): -0.1129147996E+07
 Laplacian of electron density: -0.4516297694E+07
 Electron localization function (ELF):  0.9999964537E+00
 Localized orbital locator (LOL):  0.9981203790E+00
 Local information entropy:  0.2855147204E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3021729103E+03
 Sign(lambda2)*rho with promolecular approximation: -0.2923661320E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3257170854E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2712069698E+05
 Wavefunction value for orbital         1 :  0.1054006841E-05
 Average local ionization energy (ALIE):  0.1871651823E+02
 Delta-g (under promolecular approximation):  0.4304706974E-01
 Delta-g (under Hirshfeld partition):  0.6783421629E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1590797492E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1082431586E-08 -0.3032247543E-10 -0.1207263545E-09
 Norm of gradient is:  0.1089565254E-08
 
 Components of Laplacian in x/y/z are:
 -0.1505424605E+07 -0.1505431100E+07 -0.1505441989E+07
 Total: -0.4516297694E+07
 
 Hessian matrix:
 -0.1505424605E+07 -0.1882042862E+01 -0.9697330478E+00
 -0.1882042862E+01 -0.1505431100E+07 -0.1093103494E+02
 -0.9697330478E+00 -0.1093103494E+02 -0.1505441989E+07
 Eigenvalues of Hessian: -0.1505448892E+07 -0.1505425490E+07 -0.1505423312E+07
 Eigenvectors(columns) of Hessian:
  0.7467863441E-01  0.7268939205E+00  0.6826773249E+00
  0.5277232212E+00  0.5520640501E+00 -0.6455489807E+00
  0.8461272383E+00 -0.4084733932E+00  0.3423714118E+00
 Determinant of Hessian: -0.3411802780E+19
 Ellipticity of electron density:    0.000016
 eta index:   -1.000017
 
 ----------------   CP    62,     Type (3,-3)   ----------------
 Corresponding nucleus:    86(H )
 Position (Bohr):       -2.564614540677    2.196385948885    3.863640598105
 Position (Angstrom):   -1.357135569677    1.162277390498    2.044550555637
 Density of all electrons:  0.4187107160E+00
 Density of Alpha electrons:  0.2093553580E+00
 Density of Beta electrons:  0.2093553580E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1500786444E-01
 G(r) in X,Y,Z:  0.3180988942E-02  0.4287387325E-02  0.7539488171E-02
 Hamiltonian kinetic energy K(r):  0.6050773462E+01
 Potential energy density V(r): -0.6065781326E+01
 Energy density E(r) or H(r): -0.6050773462E+01
 Laplacian of electron density: -0.2414306239E+02
 Electron localization function (ELF):  0.9995020918E+00
 Localized orbital locator (LOL):  0.9781820862E+00
 Local information entropy:  0.6234135945E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4187107160E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3004884094E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2975644847E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3744248547E+00
 Wavefunction value for orbital         1 : -0.3200814447E-05
 Average local ionization energy (ALIE):  0.6659378165E+00
 Delta-g (under promolecular approximation):  0.1798427330E+00
 Delta-g (under Hirshfeld partition):  0.3016448755E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7861847210E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1337202444E-14  0.1455475348E-14  0.1595108729E-14
 Norm of gradient is:  0.2539860374E-14
 
 Components of Laplacian in x/y/z are:
 -0.7408332949E+01 -0.8440002159E+01 -0.8294727281E+01
 Total: -0.2414306239E+02
 
 Hessian matrix:
 -0.7408332949E+01 -0.1154580771E+00  0.3823492035E+00
 -0.1154580771E+00 -0.8440002159E+01 -0.4951658563E-01
  0.3823492035E+00 -0.4951658563E-01 -0.8294727281E+01
 Eigenvalues of Hessian: -0.8455314017E+01 -0.8434814674E+01 -0.7252933697E+01
 Eigenvectors(columns) of Hessian:
  0.1683915143E-01 -0.3622101776E+00 -0.9319443278E+00
 -0.9434762379E+00 -0.3143285649E+00  0.1051196549E+00
 -0.3310121320E+00  0.8774972026E+00 -0.3470297220E+00
 Determinant of Hessian: -0.5172720273E+03
 Ellipticity of electron density:    0.002430
 eta index:   -1.165778
 
 ----------------   CP    63,     Type (3,-3)   ----------------
 Corresponding nucleus:    54(H )
 Position (Bohr):       -8.965019158052    2.640312447529    0.946622601795
 Position (Angstrom):   -4.744083833750    1.397193176896    0.500931108195
 Density of all electrons:  0.4414653499E+00
 Density of Alpha electrons:  0.2207326749E+00
 Density of Beta electrons:  0.2207326749E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6166954628E-02
 G(r) in X,Y,Z:  0.2877434605E-02  0.1409440317E-02  0.1880079705E-02
 Hamiltonian kinetic energy K(r):  0.6623152502E+01
 Potential energy density V(r): -0.6629319457E+01
 Energy density E(r) or H(r): -0.6623152502E+01
 Laplacian of electron density: -0.2646794219E+02
 Electron localization function (ELF):  0.9999293587E+00
 Localized orbital locator (LOL):  0.9916783022E+00
 Local information entropy:  0.6523431274E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4414653499E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2975782367E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1081952287E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2242230416E+00
 Wavefunction value for orbital         1 :  0.2126496981E-05
 Average local ionization energy (ALIE):  0.5299459896E+00
 Delta-g (under promolecular approximation):  0.1132930663E+00
 Delta-g (under Hirshfeld partition):  0.2011547878E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8155632217E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3450981367E-14 -0.1809444911E-14 -0.4561056428E-15
 Norm of gradient is:  0.3923186923E-14
 
 Components of Laplacian in x/y/z are:
 -0.9046313367E+01 -0.8665588454E+01 -0.8756040369E+01
 Total: -0.2646794219E+02
 
 Hessian matrix:
 -0.9046313367E+01 -0.9135618400E-01  0.7869674905E-01
 -0.9135618400E-01 -0.8665588454E+01 -0.3569414761E+00
  0.7869674905E-01 -0.3569414761E+00 -0.8756040369E+01
 Eigenvalues of Hessian: -0.9071020038E+01 -0.9066217596E+01 -0.8330704556E+01
 Eigenvectors(columns) of Hessian:
  0.2882909953E+00 -0.9430185257E+00 -0.1661456052E+00
  0.6685157543E+00  0.7399433703E-01  0.7400077867E+00
  0.6855472181E+00  0.3244085360E+00 -0.6517546421E+00
 Determinant of Hessian: -0.6851158221E+03
 Ellipticity of electron density:    0.000530
 eta index:   -1.088866
 
 ----------------   CP    64,     Type (3,-3)   ----------------
 Corresponding nucleus:    80(H )
 Position (Bohr):        1.065489295204    3.883118211985    7.423082129975
 Position (Angstrom):    0.563832653483    2.054857665025    3.928125897844
 Density of all electrons:  0.4444749868E+00
 Density of Alpha electrons:  0.2222374934E+00
 Density of Beta electrons:  0.2222374934E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6177292433E-02
 G(r) in X,Y,Z:  0.2519177502E-02  0.2052073608E-02  0.1606041324E-02
 Hamiltonian kinetic energy K(r):  0.6691315754E+01
 Potential energy density V(r): -0.6697493047E+01
 Energy density E(r) or H(r): -0.6691315754E+01
 Laplacian of electron density: -0.2674055385E+02
 Electron localization function (ELF):  0.9999307091E+00
 Localized orbital locator (LOL):  0.9917575521E+00
 Local information entropy:  0.6561505947E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4444749868E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2975936587E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8946388277E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2519805250E+00
 Wavefunction value for orbital         1 :  0.6467257894E-06
 Average local ionization energy (ALIE):  0.5212082618E+00
 Delta-g (under promolecular approximation):  0.1105630210E+00
 Delta-g (under Hirshfeld partition):  0.1964318003E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8206197828E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.7930396791E-15  0.7064661356E-15  0.3019069370E-14
 Norm of gradient is:  0.3200435313E-14
 
 Components of Laplacian in x/y/z are:
 -0.9074720857E+01 -0.9131439056E+01 -0.8534393935E+01
 Total: -0.2674055385E+02
 
 Hessian matrix:
 -0.9074720857E+01 -0.4200722633E-01  0.2147497299E+00
 -0.4200722633E-01 -0.9131439056E+01 -0.1120259279E+00
  0.2147497299E+00 -0.1120259279E+00 -0.8534393935E+01
 Eigenvalues of Hessian: -0.9153847387E+01 -0.9147921538E+01 -0.8438784922E+01
 Eigenvectors(columns) of Hessian:
 -0.5604794066E+00 -0.7615856444E+00  0.3253461862E+00
 -0.8269583166E+00  0.5358939138E+00 -0.1701694911E+00
  0.4475239954E-01  0.3644242299E+00  0.9301570853E+00
 Determinant of Hessian: -0.7066526905E+03
 Ellipticity of electron density:    0.000648
 eta index:   -1.084735
 
 ----------------   CP    65,     Type (3,-3)   ----------------
 Corresponding nucleus:    39(O )
 Position (Bohr):       12.368761364959   -0.345809402598   -3.367382089515
 Position (Angstrom):    6.545266641434   -0.182994455171   -1.781941862174
 Density of all electrons:  0.3021704078E+03
 Density of Alpha electrons:  0.1510852039E+03
 Density of Beta electrons:  0.1510852039E+03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7358184599E+02
 G(r) in X,Y,Z:  0.2628817516E+02  0.2474660542E+02  0.2254706542E+02
 Hamiltonian kinetic energy K(r):  0.1129137064E+07
 Potential energy density V(r): -0.1129210646E+07
 Energy density E(r) or H(r): -0.1129137064E+07
 Laplacian of electron density: -0.4516253928E+07
 Electron localization function (ELF):  0.9999964527E+00
 Localized orbital locator (LOL):  0.9981201133E+00
 Local information entropy:  0.2855176578E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3021704078E+03
 Sign(lambda2)*rho with promolecular approximation: -0.2923661393E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2434581384E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2802579974E+05
 Wavefunction value for orbital         1 : -0.1362887378E-05
 Average local ionization energy (ALIE):  0.1871708483E+02
 Delta-g (under promolecular approximation):  0.4298947507E-01
 Delta-g (under Hirshfeld partition):  0.6774361627E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1591802736E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2659745097E-09  0.1606451409E-10  0.8904143894E-10
 Norm of gradient is:  0.2809428523E-09
 
 Components of Laplacian in x/y/z are:
 -0.1505411181E+07 -0.1505417126E+07 -0.1505425620E+07
 Total: -0.4516253928E+07
 
 Hessian matrix:
 -0.1505411181E+07  0.2092818617E+01 -0.4675105092E+01
  0.2092818617E+01 -0.1505417126E+07  0.1109679612E+02
 -0.4675105092E+01  0.1109679612E+02 -0.1505425620E+07
 Eigenvalues of Hessian: -0.1505434352E+07 -0.1505410740E+07 -0.1505408835E+07
 Eigenvectors(columns) of Hessian:
  0.2127534867E+00  0.7906462118E+00 -0.5741206508E+00
 -0.5473004282E+00  0.5831779176E+00  0.6003047207E+00
  0.8094431389E+00  0.1864995556E+00  0.5567941456E+00
 Determinant of Hessian: -0.3411703591E+19
 Ellipticity of electron density:    0.000016
 eta index:   -1.000017
 
 ----------------   CP    66,     Type (3,-3)   ----------------
 Corresponding nucleus:    48(H )
 Position (Bohr):       -2.187953786238    0.761090620781   -6.526983744239
 Position (Angstrom):   -1.157815282186    0.402751811949   -3.453931053386
 Density of all electrons:  0.4169576845E+00
 Density of Alpha electrons:  0.2084788423E+00
 Density of Beta electrons:  0.2084788423E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1458617818E-01
 G(r) in X,Y,Z:  0.4625838781E-02  0.4396140357E-02  0.5564199042E-02
 Hamiltonian kinetic energy K(r):  0.6011563163E+01
 Potential energy density V(r): -0.6026149341E+01
 Energy density E(r) or H(r): -0.6011563163E+01
 Laplacian of electron density: -0.2398790794E+02
 Electron localization function (ELF):  0.9995230268E+00
 Localized orbital locator (LOL):  0.9786364056E+00
 Local information entropy:  0.6211741525E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4169576845E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3001569308E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1519303888E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2756176829E+00
 Wavefunction value for orbital         1 : -0.2346657325E-05
 Average local ionization energy (ALIE):  0.6696323790E+00
 Delta-g (under promolecular approximation):  0.1794927683E+00
 Delta-g (under Hirshfeld partition):  0.3009201058E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7501333275E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1730820348E-14  0.4628459074E-15  0.2101834332E-14
 Norm of gradient is:  0.2761824210E-14
 
 Components of Laplacian in x/y/z are:
 -0.7880072860E+01 -0.8235670768E+01 -0.7872164311E+01
 Total: -0.2398790794E+02
 
 Hessian matrix:
 -0.7880072860E+01 -0.2972107745E+00 -0.5147025607E+00
 -0.2972107745E+00 -0.8235670768E+01  0.2897425011E+00
 -0.5147025607E+00  0.2897425011E+00 -0.7872164311E+01
 Eigenvalues of Hessian: -0.8404324138E+01 -0.8387817627E+01 -0.7195766174E+01
 Eigenvectors(columns) of Hessian:
 -0.5391955522E+00  0.5284887521E+00 -0.6557192962E+00
 -0.8397217450E+00 -0.3968234411E+00  0.3706731008E+00
 -0.6430822305E-01  0.7504870389E+00  0.6577489315E+00
 Determinant of Hessian: -0.5072578956E+03
 Ellipticity of electron density:    0.001968
 eta index:   -1.167954
 
 ----------------   CP    67,     Type (3,-3)   ----------------
 Corresponding nucleus:    59(N )
 Position (Bohr):       -3.419624584683    1.455963584661   -5.304103711013
 Position (Angstrom):   -1.809587400058    0.770462748907   -2.806810808134
 Density of all electrons:  0.1982051649E+03
 Density of Alpha electrons:  0.9910258243E+02
 Density of Beta electrons:  0.9910258243E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2893968658E+02
 G(r) in X,Y,Z:  0.1001843697E+02  0.9110760323E+01  0.9810489291E+01
 Hamiltonian kinetic energy K(r):  0.5532120157E+06
 Potential energy density V(r): -0.5532409553E+06
 Energy density E(r) or H(r): -0.5532120157E+06
 Laplacian of electron density: -0.2212732304E+07
 Electron localization function (ELF):  0.9999977623E+00
 Localized orbital locator (LOL):  0.9985063422E+00
 Local information entropy:  0.3643600108E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1982051649E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1931687058E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4865193802E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2718739741E+05
 Wavefunction value for orbital         1 :  0.2779570312E-04
 Average local ionization energy (ALIE):  0.1424257226E+02
 Delta-g (under promolecular approximation):  0.5327914459E-01
 Delta-g (under Hirshfeld partition):  0.7882343331E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.2730421783E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3674298366E-10  0.1477193368E-11 -0.2723965498E-10
 Norm of gradient is:  0.4576273322E-10
 
 Components of Laplacian in x/y/z are:
 -0.7375759386E+06 -0.7375797629E+06 -0.7375766024E+06
 Total: -0.2212732304E+07
 
 Hessian matrix:
 -0.7375759386E+06 -0.4781837727E+01  0.4448563802E+01
 -0.4781837727E+01 -0.7375797629E+06 -0.3350354812E+01
  0.4448563802E+01 -0.3350354812E+01 -0.7375766024E+06
 Eigenvalues of Hessian: -0.7375830236E+06 -0.7375805248E+06 -0.7375687555E+06
 Eigenvectors(columns) of Hessian:
 -0.5219421758E+00 -0.5292087105E+00 -0.6689652502E+00
 -0.8490855996E+00  0.2474804299E+00  0.4666980624E+00
 -0.8142487204E-01  0.8115981626E+00 -0.5785139693E+00
 Determinant of Hessian: -0.4012572241E+18
 Ellipticity of electron density:    0.000003
 eta index:   -1.000019
 
 ----------------   CP    68,     Type (3,-3)   ----------------
 Corresponding nucleus:    35(O )
 Position (Bohr):        7.211068321500    2.910663553171    3.838396750992
 Position (Angstrom):    3.815933022002    1.540256820944    2.031192087029
 Density of all electrons:  0.3021773067E+03
 Density of Alpha electrons:  0.1510886533E+03
 Density of Beta electrons:  0.1510886533E+03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7362560909E+02
 G(r) in X,Y,Z:  0.2636081008E+02  0.2403511775E+02  0.2322968126E+02
 Hamiltonian kinetic energy K(r):  0.1129173873E+07
 Potential energy density V(r): -0.1129247498E+07
 Energy density E(r) or H(r): -0.1129173873E+07
 Laplacian of electron density: -0.4516400989E+07
 Electron localization function (ELF):  0.9999964488E+00
 Localized orbital locator (LOL):  0.9981190687E+00
 Local information entropy:  0.2855095600E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3021773067E+03
 Sign(lambda2)*rho with promolecular approximation: -0.2923663848E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2106261360E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.4144383824E+05
 Wavefunction value for orbital         1 : -0.7960235361E-06
 Average local ionization energy (ALIE):  0.1872146142E+02
 Delta-g (under promolecular approximation):  0.4281502008E-01
 Delta-g (under Hirshfeld partition):  0.6752242177E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1601509976E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2668986560E-11 -0.5763192354E-10  0.3092899097E-09
 Norm of gradient is:  0.3146248724E-09
 
 Components of Laplacian in x/y/z are:
 -0.1505460022E+07 -0.1505468887E+07 -0.1505472079E+07
 Total: -0.4516400989E+07
 
 Hessian matrix:
 -0.1505460022E+07 -0.1399033835E+01  0.1494850518E-01
 -0.1399033835E+01 -0.1505468887E+07  0.1289163052E+02
  0.1494850518E-01  0.1289163052E+02 -0.1505472079E+07
 Eigenvalues of Hessian: -0.1505483511E+07 -0.1505460360E+07 -0.1505457118E+07
 Eigenvectors(columns) of Hessian:
  0.3996035262E-01  0.9395459456E+00  0.3400832050E+00
  0.6629146245E+00  0.2297336578E+00 -0.7125774674E+00
 -0.7476278291E+00  0.2539209770E+00 -0.6136585098E+00
 Determinant of Hessian: -0.3412036884E+19
 Ellipticity of electron density:    0.000015
 eta index:   -1.000018
 
 ----------------   CP    69,     Type (3,-3)   ----------------
 Corresponding nucleus:     1(C )
 Position (Bohr):        1.589925703292    1.789046418418   -2.737402325865
 Position (Angstrom):    0.841352449211    0.946722593875   -1.448570927921
 Density of all electrons:  0.1222176482E+03
 Density of Alpha electrons:  0.6110882412E+02
 Density of Beta electrons:  0.6110882412E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8345361285E+01
 G(r) in X,Y,Z:  0.3150956127E+01  0.2702417950E+01  0.2491987207E+01
 Hamiltonian kinetic energy K(r):  0.2423512527E+06
 Potential energy density V(r): -0.2423595981E+06
 Energy density E(r) or H(r): -0.2423512527E+06
 Laplacian of electron density: -0.9693716295E+06
 Electron localization function (ELF):  0.9999990675E+00
 Localized orbital locator (LOL):  0.9990352810E+00
 Local information entropy:  0.3498675751E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1222176482E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213912608E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3963518800E-01
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2121451661E+05
 Wavefunction value for orbital         1 : -0.4457235075E-05
 Average local ionization energy (ALIE):  0.1029705490E+02
 Delta-g (under promolecular approximation):  0.4550169149E-01
 Delta-g (under Hirshfeld partition):  0.5806042051E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1789559275E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.7488801246E-12  0.2757982558E-10  0.6848684814E-10
 Norm of gradient is:  0.7383533008E-10
 
 Components of Laplacian in x/y/z are:
 -0.3231225480E+06 -0.3231242709E+06 -0.3231248106E+06
 Total: -0.9693716295E+06
 
 Hessian matrix:
 -0.3231225480E+06 -0.1081316151E+01  0.1170474255E+01
 -0.1081316151E+01 -0.3231242709E+06 -0.7234656945E-01
  0.1170474255E+01 -0.7234656945E-01 -0.3231248106E+06
 Eigenvalues of Hessian: -0.3231254520E+06 -0.3231245307E+06 -0.3231216467E+06
 Eigenvectors(columns) of Hessian:
 -0.4632532391E+00  0.1712596535E+00 -0.8695208839E+00
 -0.3749312957E+00  0.8511460286E+00  0.3673921087E+00
  0.8030086923E+00  0.4962061760E+00 -0.3300855509E+00
 Determinant of Hessian: -0.3373705360E+17
 Ellipticity of electron density:    0.000003
 eta index:   -1.000012
 
 ----------------   CP    70,     Type (3,-3)   ----------------
 Corresponding nucleus:    70(C )
 Position (Bohr):        0.414647525255    4.245896152929    5.525986800153
 Position (Angstrom):    0.219422020922    2.246831483991    2.924226282392
 Density of all electrons:  0.1220213613E+03
 Density of Alpha electrons:  0.6101068064E+02
 Density of Beta electrons:  0.6101068064E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8599417049E+01
 G(r) in X,Y,Z:  0.2976530407E+01  0.2555750304E+01  0.3067136338E+01
 Hamiltonian kinetic energy K(r):  0.2419263631E+06
 Potential energy density V(r): -0.2419349625E+06
 Energy density E(r) or H(r): -0.2419263631E+06
 Laplacian of electron density: -0.9676710548E+06
 Electron localization function (ELF):  0.9999990046E+00
 Localized orbital locator (LOL):  0.9990032776E+00
 Local information entropy:  0.3497212003E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1220213613E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213905531E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4377348073E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1103043181E+05
 Wavefunction value for orbital         1 : -0.1111393372E-05
 Average local ionization energy (ALIE):  0.1023798305E+02
 Delta-g (under promolecular approximation):  0.4112924087E-01
 Delta-g (under Hirshfeld partition):  0.5381419751E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1634715547E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.6683199133E-11 -0.1321072713E-09  0.5232610699E-10
 Norm of gradient is:  0.1422498427E-09
 
 Components of Laplacian in x/y/z are:
 -0.3225566010E+06 -0.3225581961E+06 -0.3225562578E+06
 Total: -0.9676710548E+06
 
 Hessian matrix:
 -0.3225566010E+06 -0.1051648727E+01 -0.5451524328E+00
 -0.1051648727E+01 -0.3225581961E+06 -0.9704076154E+00
 -0.5451524328E+00 -0.9704076154E+00 -0.3225562578E+06
 Eigenvalues of Hessian: -0.3225591463E+06 -0.3225560893E+06 -0.3225558192E+06
 Eigenvectors(columns) of Hessian:
 -0.4210492335E+00  0.8429860478E+00 -0.3348015326E+00
 -0.8328547950E+00 -0.5055129709E+00 -0.2254096862E+00
 -0.3592637379E+00  0.1839324862E+00  0.9149308210E+00
 Determinant of Hessian: -0.3355980954E+17
 Ellipticity of electron density:    0.000009
 eta index:   -1.000010
 
 ----------------   CP    71,     Type (3,-3)   ----------------
 Corresponding nucleus:     6(C )
 Position (Bohr):        3.896145549456    1.980167173783   -1.405670750311
 Position (Angstrom):    2.061751435133    1.047859342144   -0.743848927098
 Density of all electrons:  0.1220929007E+03
 Density of Alpha electrons:  0.6104645037E+02
 Density of Beta electrons:  0.6104645037E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8722212233E+01
 G(r) in X,Y,Z:  0.2961710588E+01  0.2846169960E+01  0.2914331684E+01
 Hamiltonian kinetic energy K(r):  0.2420871813E+06
 Potential energy density V(r): -0.2420959035E+06
 Energy density E(r) or H(r): -0.2420871813E+06
 Laplacian of electron density: -0.9683138364E+06
 Electron localization function (ELF):  0.9999989779E+00
 Localized orbital locator (LOL):  0.9989900454E+00
 Local information entropy:  0.3497746260E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1220929007E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213952174E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2174996159E-02
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1678427841E+05
 Wavefunction value for orbital         1 : -0.3301995653E-05
 Average local ionization energy (ALIE):  0.1026358675E+02
 Delta-g (under promolecular approximation):  0.4311210981E-01
 Delta-g (under Hirshfeld partition):  0.5600285037E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4005329454E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.7925590739E-11 -0.2318653256E-10  0.3565657491E-10
 Norm of gradient is:  0.4326455380E-10
 
 Components of Laplacian in x/y/z are:
 -0.3227711204E+06 -0.3227716775E+06 -0.3227710384E+06
 Total: -0.9683138364E+06
 
 Hessian matrix:
 -0.3227711204E+06  0.4252005681E+00  0.2780576179E+00
  0.4252005681E+00 -0.3227716775E+06  0.1442615059E+00
  0.2780576179E+00  0.1442615059E+00 -0.3227710384E+06
 Eigenvalues of Hessian: -0.3227719073E+06 -0.3227712863E+06 -0.3227706427E+06
 Eigenvectors(columns) of Hessian:
 -0.4772248494E+00 -0.5428829555E+00  0.6910387397E+00
  0.8787547664E+00 -0.3009075555E+00  0.3704655228E+00
  0.6819359993E-02  0.7840489396E+00  0.6206615476E+00
 Determinant of Hessian: -0.3362673092E+17
 Ellipticity of electron density:    0.000002
 eta index:   -1.000004
 
 ----------------   CP    72,     Type (3,-3)   ----------------
 Corresponding nucleus:    79(H )
 Position (Bohr):        2.037872050857    4.705453246169    4.394633685208
 Position (Angstrom):    1.078395448050    2.490018624842    2.325539996479
 Density of all electrons:  0.4479836798E+00
 Density of Alpha electrons:  0.2239918399E+00
 Density of Beta electrons:  0.2239918399E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6858128174E-02
 G(r) in X,Y,Z:  0.2117787927E-02  0.2274312173E-02  0.2466028074E-02
 Hamiltonian kinetic energy K(r):  0.6763647385E+01
 Potential energy density V(r): -0.6770505513E+01
 Energy density E(r) or H(r): -0.6763647385E+01
 Laplacian of electron density: -0.2702715703E+02
 Electron localization function (ELF):  0.9999168307E+00
 Localized orbital locator (LOL):  0.9909753670E+00
 Local information entropy:  0.6605839650E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4479836798E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2985030068E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.9195705244E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3184744986E+00
 Wavefunction value for orbital         1 : -0.9132057448E-06
 Average local ionization energy (ALIE):  0.5246705841E+00
 Delta-g (under promolecular approximation):  0.1125144375E+00
 Delta-g (under Hirshfeld partition):  0.2007726234E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8855151995E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.6895525817E-15 -0.3199561926E-14 -0.8181389594E-15
 Norm of gradient is:  0.3373726521E-14
 
 Components of Laplacian in x/y/z are:
 -0.8787138857E+01 -0.9208268619E+01 -0.9031749552E+01
 Total: -0.2702715703E+02
 
 Hessian matrix:
 -0.8787138857E+01  0.1355333405E+00 -0.3187444793E+00
  0.1355333405E+00 -0.9208268619E+01 -0.9668556031E-01
 -0.3187444793E+00 -0.9668556031E-01 -0.9031749552E+01
 Eigenvalues of Hessian: -0.9252878925E+01 -0.9246931793E+01 -0.8527346310E+01
 Eigenvectors(columns) of Hessian:
 -0.3459987415E+00 -0.4902308631E+00 -0.7999741069E+00
 -0.5677338507E+00  0.7882160921E+00 -0.2374735077E+00
 -0.7469693070E+00 -0.3720068454E+00  0.5510424316E+00
 Determinant of Hessian: -0.7296060631E+03
 Ellipticity of electron density:    0.000643
 eta index:   -1.085083
 
 ----------------   CP    73,     Type (3,-3)   ----------------
 Corresponding nucleus:    81(H )
 Position (Bohr):       -2.939551808390    6.109849978039    6.796581692608
 Position (Angstrom):   -1.555543827269    3.233193370414    3.596596143769
 Density of all electrons:  0.4433836814E+00
 Density of Alpha electrons:  0.2216918407E+00
 Density of Beta electrons:  0.2216918407E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6717812523E-02
 G(r) in X,Y,Z:  0.1930722357E-02  0.2575523015E-02  0.2211567151E-02
 Hamiltonian kinetic energy K(r):  0.6673630153E+01
 Potential energy density V(r): -0.6680347965E+01
 Energy density E(r) or H(r): -0.6673630153E+01
 Laplacian of electron density: -0.2666764936E+02
 Electron localization function (ELF):  0.9999174008E+00
 Localized orbital locator (LOL):  0.9910063451E+00
 Local information entropy:  0.6547704936E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4433836814E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2981635007E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1657957166E-09
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2210509763E+00
 Wavefunction value for orbital         1 : -0.9097811048E-06
 Average local ionization energy (ALIE):  0.5094245621E+00
 Delta-g (under promolecular approximation):  0.1106329536E+00
 Delta-g (under Hirshfeld partition):  0.1947622590E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8058710190E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.7981625343E-15  0.8401171350E-15  0.2234757518E-14
 Norm of gradient is:  0.2517340143E-14
 
 Components of Laplacian in x/y/z are:
 -0.8727553151E+01 -0.9097292180E+01 -0.8842804029E+01
 Total: -0.2666764936E+02
 
 Hessian matrix:
 -0.8727553151E+01  0.8924497594E-01 -0.3273929321E+00
  0.8924497594E-01 -0.9097292180E+01 -0.7423876343E-01
 -0.3273929321E+00 -0.7423876343E-01 -0.8842804029E+01
 Eigenvalues of Hessian: -0.9118089137E+01 -0.9117077475E+01 -0.8432482748E+01
 Eigenvectors(columns) of Hessian:
  0.5550673320E+00 -0.3499423940E+00  0.7546128662E+00
 -0.6819978785E+00 -0.7108381096E+00  0.1720118472E+00
  0.4762133457E+00 -0.6101225310E+00 -0.6332229833E+00
 Determinant of Hessian: -0.7009950322E+03
 Ellipticity of electron density:    0.000111
 eta index:   -1.081305
 
 ----------------   CP    74,     Type (3,-3)   ----------------
 Corresponding nucleus:     7(C )
 Position (Bohr):       -2.639964419142    3.639208989324   -3.947221724310
 Position (Angstrom):   -1.397009008205    1.925786462864   -2.088779782886
 Density of all electrons:  0.1221336677E+03
 Density of Alpha electrons:  0.6106683386E+02
 Density of Beta electrons:  0.6106683386E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8569209910E+01
 G(r) in X,Y,Z:  0.3159558544E+01  0.2826762046E+01  0.2582889320E+01
 Hamiltonian kinetic energy K(r):  0.2421719107E+06
 Potential energy density V(r): -0.2421804799E+06
 Energy density E(r) or H(r): -0.2421719107E+06
 Laplacian of electron density: -0.9686533661E+06
 Electron localization function (ELF):  0.9999990146E+00
 Localized orbital locator (LOL):  0.9990082955E+00
 Local information entropy:  0.3498050311E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221336677E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213938226E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4730105513E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1288411351E+05
 Wavefunction value for orbital         1 :  0.1790696969E-05
 Average local ionization energy (ALIE):  0.1027094149E+02
 Delta-g (under promolecular approximation):  0.4031763946E-01
 Delta-g (under Hirshfeld partition):  0.5244078880E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1841422016E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.7105670219E-10  0.6083886520E-10  0.2667791682E-10
 Norm of gradient is:  0.9727349942E-10
 
 Components of Laplacian in x/y/z are:
 -0.3228834297E+06 -0.3228846411E+06 -0.3228852952E+06
 Total: -0.9686533661E+06
 
 Hessian matrix:
 -0.3228834297E+06 -0.1067000063E+01  0.9372565890E-01
 -0.1067000063E+01 -0.3228846411E+06 -0.1456963281E+00
  0.9372565890E-01 -0.1456963281E+00 -0.3228852952E+06
 Eigenvalues of Hessian: -0.3228853650E+06 -0.3228852022E+06 -0.3228827990E+06
 Eigenvectors(columns) of Hessian:
 -0.2647187605E+00 -0.4331883254E+00 -0.8615520023E+00
 -0.5497156920E+00 -0.6662572785E+00  0.5038986970E+00
 -0.7922983250E+00  0.6070000936E+00 -0.6175961905E-01
 Determinant of Hessian: -0.3366211596E+17
 Ellipticity of electron density:    0.000001
 eta index:   -1.000008
 
 ----------------   CP    75,     Type (3,-3)   ----------------
 Corresponding nucleus:     2(C )
 Position (Bohr):       -0.199813672921    3.794450692473   -2.807897072537
 Position (Angstrom):   -0.105736842136    2.007936834352   -1.485875141348
 Density of all electrons:  0.1221397318E+03
 Density of Alpha electrons:  0.6106986591E+02
 Density of Beta electrons:  0.6106986591E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8787538539E+01
 G(r) in X,Y,Z:  0.3032599123E+01  0.3070485046E+01  0.2684454370E+01
 Hamiltonian kinetic energy K(r):  0.2421864918E+06
 Potential energy density V(r): -0.2421952793E+06
 Energy density E(r) or H(r): -0.2421864918E+06
 Laplacian of electron density: -0.9687108170E+06
 Electron localization function (ELF):  0.9999989639E+00
 Localized orbital locator (LOL):  0.9989831383E+00
 Local information entropy:  0.3498095514E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221397318E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213984015E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1010642271E-02
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1631612697E+05
 Wavefunction value for orbital         1 : -0.5763164889E-05
 Average local ionization energy (ALIE):  0.1024110464E+02
 Delta-g (under promolecular approximation):  0.4122164999E-01
 Delta-g (under Hirshfeld partition):  0.5453007091E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1181241246E+08
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4093027133E-11 -0.6840891135E-10  0.3319929921E-10
 Norm of gradient is:  0.7614936304E-10
 
 Components of Laplacian in x/y/z are:
 -0.3229033106E+06 -0.3229031626E+06 -0.3229043439E+06
 Total: -0.9687108170E+06
 
 Hessian matrix:
 -0.3229033106E+06 -0.8047317140E-01  0.5656405398E+00
 -0.8047317140E-01 -0.3229031626E+06  0.6790670071E+00
  0.5656405398E+00  0.6790670071E+00 -0.3229043439E+06
 Eigenvalues of Hessian: -0.3229048500E+06 -0.3229031845E+06 -0.3229027825E+06
 Eigenvectors(columns) of Hessian:
 -0.3378242329E+00  0.8524284653E+00  0.3990494947E+00
 -0.3651993086E+00 -0.5094741274E+00  0.7791441320E+00
  0.8674700298E+00  0.1174811692E+00  0.4834189925E+00
 Determinant of Hessian: -0.3366810583E+17
 Ellipticity of electron density:    0.000005
 eta index:   -1.000006
 
 ----------------   CP    76,     Type (3,-3)   ----------------
 Corresponding nucleus:    71(C )
 Position (Bohr):       -1.410131557167    6.468513366662    5.496009704186
 Position (Angstrom):   -0.746209484428    3.422989862059    2.908363086357
 Density of all electrons:  0.1220004275E+03
 Density of Alpha electrons:  0.6100021373E+02
 Density of Beta electrons:  0.6100021373E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8727214337E+01
 G(r) in X,Y,Z:  0.2883599261E+01  0.2813318644E+01  0.3030296432E+01
 Hamiltonian kinetic energy K(r):  0.2418761243E+06
 Potential energy density V(r): -0.2418848515E+06
 Energy density E(r) or H(r): -0.2418761243E+06
 Laplacian of electron density: -0.9674695884E+06
 Electron localization function (ELF):  0.9999989742E+00
 Localized orbital locator (LOL):  0.9989881911E+00
 Local information entropy:  0.3497055501E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1220004275E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213949676E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1065723485E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8947572491E+04
 Wavefunction value for orbital         1 : -0.3041979552E-05
 Average local ionization energy (ALIE):  0.1020050474E+02
 Delta-g (under promolecular approximation):  0.3891385550E-01
 Delta-g (under Hirshfeld partition):  0.5170276271E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5875886054E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1295415498E-10 -0.6869066015E-10 -0.7307440243E-10
 Norm of gradient is:  0.1011241080E-09
 
 Components of Laplacian in x/y/z are:
 -0.3224899576E+06 -0.3224902346E+06 -0.3224893962E+06
 Total: -0.9674695884E+06
 
 Hessian matrix:
 -0.3224899576E+06  0.2795836706E+00 -0.1056804774E+00
  0.2795836706E+00 -0.3224902346E+06 -0.4792317014E-01
 -0.1056804774E+00 -0.4792317014E-01 -0.3224893962E+06
 Eigenvalues of Hessian: -0.3224904083E+06 -0.3224898156E+06 -0.3224893644E+06
 Eigenvectors(columns) of Hessian:
 -0.5296220160E+00  0.8158987678E+00 -0.2319692239E+00
  0.8480985755E+00  0.5142337491E+00 -0.1276419112E+00
 -0.1514352565E-01  0.2643347347E+00  0.9643120976E+00
 Determinant of Hessian: -0.3353885273E+17
 Ellipticity of electron density:    0.000002
 eta index:   -1.000003
 
 ----------------   CP    77,     Type (3,-3)   ----------------
 Corresponding nucleus:     5(C )
 Position (Bohr):        4.493023940339    4.308731419567   -0.165945717860
 Position (Angstrom):    2.377605877269    2.280082475137   -0.087814692139
 Density of all electrons:  0.1221905935E+03
 Density of Alpha electrons:  0.6109529673E+02
 Density of Beta electrons:  0.6109529673E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8614399138E+01
 G(r) in X,Y,Z:  0.2849459162E+01  0.3143682072E+01  0.2621257904E+01
 Hamiltonian kinetic energy K(r):  0.2422891367E+06
 Potential energy density V(r): -0.2422977511E+06
 Energy density E(r) or H(r): -0.2422891367E+06
 Laplacian of electron density: -0.9691220891E+06
 Electron localization function (ELF):  0.9999990057E+00
 Localized orbital locator (LOL):  0.9990038442E+00
 Local information entropy:  0.3498474395E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221905935E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213918384E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1104258152E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1238411289E+05
 Wavefunction value for orbital         1 :  0.1383823216E-05
 Average local ionization energy (ALIE):  0.1024414001E+02
 Delta-g (under promolecular approximation):  0.2795541781E-01
 Delta-g (under Hirshfeld partition):  0.3816937876E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.2971747016E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4250679236E-10 -0.4912996832E-10 -0.2566340369E-11
 Norm of gradient is:  0.6501666930E-10
 
 Components of Laplacian in x/y/z are:
 -0.3230407732E+06 -0.3230398390E+06 -0.3230414769E+06
 Total: -0.9691220891E+06
 
 Hessian matrix:
 -0.3230407732E+06 -0.8733017068E+00  0.8827041366E-01
 -0.8733017068E+00 -0.3230398390E+06  0.2678781880E+00
  0.8827041366E-01  0.2678781880E+00 -0.3230414769E+06
 Eigenvalues of Hessian: -0.3230416287E+06 -0.3230411605E+06 -0.3230392999E+06
 Eigenvectors(columns) of Hessian:
 -0.4282003082E+00  0.7499117084E+00  0.5042587885E+00
 -0.3345935486E+00  0.3867809144E+00 -0.8593297862E+00
  0.8394591433E+00  0.5366870167E+00 -0.8529591292E-01
 Determinant of Hessian: -0.3371100604E+17
 Ellipticity of electron density:    0.000001
 eta index:   -1.000007
 
 ----------------   CP    78,     Type (3,-3)   ----------------
 Corresponding nucleus:    28(S )
 Position (Bohr):        7.291092558929    4.866734529499    1.776142295998
 Position (Angstrom):    3.858280024769    2.575365004526    0.939894026363
 Density of all electrons:  0.2570173261E+04
 Density of Alpha electrons:  0.1285086631E+04
 Density of Beta electrons:  0.1285086631E+04
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.9710566303E+04
 G(r) in X,Y,Z:  0.3236588396E+04  0.3237183735E+04  0.3236794172E+04
 Hamiltonian kinetic energy K(r):  0.2868684479E+08
 Potential energy density V(r): -0.2869655536E+08
 Energy density E(r) or H(r): -0.2868684479E+08
 Laplacian of electron density: -0.1147085369E+09
 Electron localization function (ELF):  0.9999508199E+00
 Localized orbital locator (LOL):  0.9930358164E+00
 Local information entropy: -0.9228390094E+01
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2570173261E+04
 Sign(lambda2)*rho with promolecular approximation: -0.2661174025E+04
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6054407135E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1020566666E+07
 Wavefunction value for orbital         1 : -0.1735843326E-05
 Average local ionization energy (ALIE):  0.8382402116E+02
 Delta-g (under promolecular approximation):  0.2561727501E-01
 Delta-g (under Hirshfeld partition):  0.1542112621E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.2359063661E+09
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1222328227E-07  0.4322567099E-08  0.2879139868E-08
 Norm of gradient is:  0.1328091345E-07
 
 Components of Laplacian in x/y/z are:
 -0.3823618018E+08 -0.3823617750E+08 -0.3823617923E+08
 Total: -0.1147085369E+09
 
 Hessian matrix:
 -0.3823618018E+08 -0.1612585603E+01 -0.7273758714E+01
 -0.1612585603E+01 -0.3823617750E+08 -0.6107375397E+00
 -0.7273758714E+01 -0.6107375397E+00 -0.3823617923E+08
 Eigenvalues of Hessian: -0.3823618725E+08 -0.3823617732E+08 -0.3823617233E+08
 Eigenvectors(columns) of Hessian:
 -0.7250577388E+00  0.2828527279E-01 -0.6881069820E+00
 -0.1617795135E+00 -0.9781924096E+00  0.1302574330E+00
 -0.6694166598E+00  0.2057657726E+00  0.7138219543E+00
 Determinant of Hessian: -0.5590149943E+23
 Ellipticity of electron density:    0.000000
 eta index:   -1.000000
 
 ----------------   CP    79,     Type (3,-3)   ----------------
 Corresponding nucleus:    82(H )
 Position (Bohr):       -2.231260884171    6.615588067015    3.635822227125
 Position (Angstrom):   -1.180732411483    3.500818441786    1.923994265489
 Density of all electrons:  0.4439829535E+00
 Density of Alpha electrons:  0.2219914768E+00
 Density of Beta electrons:  0.2219914768E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6935135829E-02
 G(r) in X,Y,Z:  0.2543111942E-02  0.2636995603E-02  0.1755028284E-02
 Hamiltonian kinetic energy K(r):  0.6701303620E+01
 Potential energy density V(r): -0.6708238756E+01
 Energy density E(r) or H(r): -0.6701303620E+01
 Laplacian of electron density: -0.2677747394E+02
 Electron localization function (ELF):  0.9999123742E+00
 Localized orbital locator (LOL):  0.9907387761E+00
 Local information entropy:  0.6555284234E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4439829535E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2984889930E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2753735278E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2707016801E+00
 Wavefunction value for orbital         1 :  0.1037656426E-05
 Average local ionization energy (ALIE):  0.5101102663E+00
 Delta-g (under promolecular approximation):  0.1110338705E+00
 Delta-g (under Hirshfeld partition):  0.1954004291E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8649250991E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.8573735255E-15  0.1848442731E-14  0.1721306474E-14
 Norm of gradient is:  0.2667344348E-14
 
 Components of Laplacian in x/y/z are:
 -0.9040600114E+01 -0.9150904854E+01 -0.8585968968E+01
 Total: -0.2677747394E+02
 
 Hessian matrix:
 -0.9040600114E+01 -0.2146687161E-01  0.2550119681E+00
 -0.2146687161E-01 -0.9150904854E+01 -0.4819246089E-01
  0.2550119681E+00 -0.4819246089E-01 -0.8585968968E+01
 Eigenvalues of Hessian: -0.9155068563E+01 -0.9154813016E+01 -0.8467592358E+01
 Eigenvectors(columns) of Hessian:
  0.5175158224E+00 -0.7522515517E+00  0.4077928108E+00
 -0.8014474338E+00 -0.5930904244E+00 -0.7697895457E-01
 -0.2997655492E+00  0.2869866748E+00  0.9098237544E+00
 Determinant of Hessian: -0.7096938173E+03
 Ellipticity of electron density:    0.000028
 eta index:   -1.081189
 
 ----------------   CP    80,     Type (3,-3)   ----------------
 Corresponding nucleus:    34(O )
 Position (Bohr):        9.537611895843    4.684775037983    0.065797696841
 Position (Angstrom):    5.047086861717    2.479076188308    0.034818641698
 Density of all electrons:  0.3021896713E+03
 Density of Alpha electrons:  0.1510948356E+03
 Density of Beta electrons:  0.1510948356E+03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7357995043E+02
 G(r) in X,Y,Z:  0.2247732752E+02  0.2699603965E+02  0.2410658326E+02
 Hamiltonian kinetic energy K(r):  0.1129217909E+07
 Potential energy density V(r): -0.1129291489E+07
 Energy density E(r) or H(r): -0.1129217909E+07
 Laplacian of electron density: -0.4516577314E+07
 Electron localization function (ELF):  0.9999964536E+00
 Localized orbital locator (LOL):  0.9981203610E+00
 Local information entropy:  0.2854950459E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3021896713E+03
 Sign(lambda2)*rho with promolecular approximation: -0.2923659259E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2507599002E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3382353401E+05
 Wavefunction value for orbital         1 :  0.6231215785E-08
 Average local ionization energy (ALIE):  0.1871824053E+02
 Delta-g (under promolecular approximation):  0.4382752703E-01
 Delta-g (under Hirshfeld partition):  0.6906127774E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1564891680E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2587030219E-09  0.6664883846E-09  0.9583631631E-13
 Norm of gradient is:  0.7149363814E-09
 
 Components of Laplacian in x/y/z are:
 -0.1505533699E+07 -0.1505516194E+07 -0.1505527422E+07
 Total: -0.4516577314E+07
 
 Hessian matrix:
 -0.1505533699E+07  0.6008700669E+00  0.1108596069E+02
  0.6008700669E+00 -0.1505516194E+07 -0.4940543568E+00
  0.1108596069E+02 -0.4940543568E+00 -0.1505527422E+07
 Eigenvalues of Hessian: -0.1505542105E+07 -0.1505519039E+07 -0.1505516170E+07
 Eigenvectors(columns) of Hessian:
 -0.7972384404E+00 -0.6034176740E+00  0.1726209366E-01
  0.2998328273E-01 -0.1102145687E-01  0.9994896349E+00
  0.6029194572E+00 -0.7973491320E+00 -0.2687917181E-01
 Determinant of Hessian: -0.3412436530E+19
 Ellipticity of electron density:    0.000015
 eta index:   -1.000017
 
 ----------------   CP    81,     Type (3,-3)   ----------------
 Corresponding nucleus:    42(H )
 Position (Bohr):       -6.143141031217    5.433210949805   -4.546227498945
 Position (Angstrom):   -3.250810237083    2.875131416665   -2.405759988022
 Density of all electrons:  0.4353523896E+00
 Density of Alpha electrons:  0.2176761948E+00
 Density of Beta electrons:  0.2176761948E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6015063913E-02
 G(r) in X,Y,Z:  0.1325812415E-02  0.2262347964E-02  0.2426903533E-02
 Hamiltonian kinetic energy K(r):  0.6520675809E+01
 Potential energy density V(r): -0.6526690873E+01
 Energy density E(r) or H(r): -0.6520675809E+01
 Laplacian of electron density: -0.2605864298E+02
 Electron localization function (ELF):  0.9999295925E+00
 Localized orbital locator (LOL):  0.9916923081E+00
 Local information entropy:  0.6445962578E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4353523896E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2976323915E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1371834850E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2211479458E+00
 Wavefunction value for orbital         1 : -0.2200030556E-05
 Average local ionization energy (ALIE):  0.5606537687E+00
 Delta-g (under promolecular approximation):  0.1153400522E+00
 Delta-g (under Hirshfeld partition):  0.2045423074E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8083472113E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4981942864E-15 -0.2365576674E-14 -0.1550070293E-15
 Norm of gradient is:  0.2422432193E-14
 
 Components of Laplacian in x/y/z are:
 -0.8312137635E+01 -0.8939989434E+01 -0.8806515913E+01
 Total: -0.2605864298E+02
 
 Hessian matrix:
 -0.8312137635E+01  0.5975136107E-01  0.2947835744E+00
  0.5975136107E-01 -0.8939989434E+01  0.2674091804E-01
  0.2947835744E+00  0.2674091804E-01 -0.8806515913E+01
 Eigenvalues of Hessian: -0.8946063036E+01 -0.8943517901E+01 -0.8169062045E+01
 Eigenvectors(columns) of Hessian:
 -0.2588236863E+00 -0.3428316266E+00  0.9030375270E+00
  0.8896234958E+00 -0.4487906620E+00  0.8459892049E-01
  0.3762716241E+00  0.8252596061E+00  0.4211487236E+00
 Determinant of Hessian: -0.6536007309E+03
 Ellipticity of electron density:    0.000285
 eta index:   -1.095115
 
 ----------------   CP    82,     Type (3,-3)   ----------------
 Corresponding nucleus:     8(C )
 Position (Bohr):       -4.323488915285    5.596900707327   -3.702277031200
 Position (Angstrom):   -2.287891805561    2.961752306004   -1.959160633361
 Density of all electrons:  0.1222021137E+03
 Density of Alpha electrons:  0.6110105684E+02
 Density of Beta electrons:  0.6110105684E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8790792895E+01
 G(r) in X,Y,Z:  0.3139450515E+01  0.3028700058E+01  0.2622642322E+01
 Hamiltonian kinetic energy K(r):  0.2423029001E+06
 Potential energy density V(r): -0.2423116909E+06
 Energy density E(r) or H(r): -0.2423029001E+06
 Laplacian of electron density: -0.9691764374E+06
 Electron localization function (ELF):  0.9999989649E+00
 Localized orbital locator (LOL):  0.9989836266E+00
 Local information entropy:  0.3498560150E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1222021137E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213970358E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6598431379E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9661377509E+04
 Wavefunction value for orbital         1 : -0.1008896074E-04
 Average local ionization energy (ALIE):  0.1021647396E+02
 Delta-g (under promolecular approximation):  0.4558973957E-01
 Delta-g (under Hirshfeld partition):  0.6096684429E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6186050165E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4640119192E-10 -0.3853486974E-11 -0.7168108468E-10
 Norm of gradient is:  0.8547571511E-10
 
 Components of Laplacian in x/y/z are:
 -0.3230581004E+06 -0.3230585336E+06 -0.3230598033E+06
 Total: -0.9691764374E+06
 
 Hessian matrix:
 -0.3230581004E+06 -0.4459330205E+00  0.7831540063E+00
 -0.4459330205E+00 -0.3230585336E+06  0.9610205864E+00
  0.7831540063E+00  0.9610205864E+00 -0.3230598033E+06
 Eigenvalues of Hessian: -0.3230606399E+06 -0.3230580185E+06 -0.3230577790E+06
 Eigenvectors(columns) of Hessian:
 -0.3343785348E+00  0.8001029472E-01  0.9390363934E+00
 -0.4488826201E+00  0.8625879055E+00 -0.2333377352E+00
  0.8286708567E+00  0.4995402467E+00  0.2525156493E+00
 Determinant of Hessian: -0.3371667789E+17
 Ellipticity of electron density:    0.000008
 eta index:   -1.000009
 
 ----------------   CP    83,     Type (3,-3)   ----------------
 Corresponding nucleus:     3(C )
 Position (Bohr):        0.464230080356    6.059516040883   -1.518954548707
 Position (Angstrom):    0.245659979140    3.206557797936   -0.803796131573
 Density of all electrons:  0.1221812247E+03
 Density of Alpha electrons:  0.6109061235E+02
 Density of Beta electrons:  0.6109061235E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8717067962E+01
 G(r) in X,Y,Z:  0.3095281988E+01  0.3049520479E+01  0.2572265494E+01
 Hamiltonian kinetic energy K(r):  0.2422709351E+06
 Potential energy density V(r): -0.2422796522E+06
 Energy density E(r) or H(r): -0.2422709351E+06
 Laplacian of electron density: -0.9690488721E+06
 Electron localization function (ELF):  0.9999989816E+00
 Localized orbital locator (LOL):  0.9989918550E+00
 Local information entropy:  0.3498404639E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1221812247E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213994311E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1351342241E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1231030270E+05
 Wavefunction value for orbital         1 : -0.2251602161E-05
 Average local ionization energy (ALIE):  0.1023455784E+02
 Delta-g (under promolecular approximation):  0.4318152240E-01
 Delta-g (under Hirshfeld partition):  0.5701748099E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1318266771E+08
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1282954103E-11  0.2305381125E-10 -0.2894209525E-10
 Norm of gradient is:  0.3702389852E-10
 
 Components of Laplacian in x/y/z are:
 -0.3230156524E+06 -0.3230158209E+06 -0.3230173988E+06
 Total: -0.9690488721E+06
 
 Hessian matrix:
 -0.3230156524E+06 -0.4976991970E+00  0.9244676437E+00
 -0.4976991970E+00 -0.3230158209E+06  0.8397965969E+00
  0.9244676437E+00  0.8397965969E+00 -0.3230173988E+06
 Eigenvalues of Hessian: -0.3230181933E+06 -0.3230154835E+06 -0.3230151953E+06
 Eigenvectors(columns) of Hessian:
 -0.3810376198E+00  0.2747120360E+00  0.8828044119E+00
 -0.3785315144E+00  0.8247902557E+00 -0.4200415773E+00
  0.8435189535E+00  0.4942209338E+00  0.2102889528E+00
 Determinant of Hessian: -0.3370336603E+17
 Ellipticity of electron density:    0.000008
 eta index:   -1.000009
 
 ----------------   CP    84,     Type (3,-3)   ----------------
 Corresponding nucleus:     4(C )
 Position (Bohr):        2.826695376694    6.268022410913   -0.273608384628
 Position (Angstrom):    1.495822775511    3.316894617285   -0.144787321857
 Density of all electrons:  0.1222032892E+03
 Density of Alpha electrons:  0.6110164459E+02
 Density of Beta electrons:  0.6110164459E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8792217062E+01
 G(r) in X,Y,Z:  0.3003501406E+01  0.3160983791E+01  0.2627731865E+01
 Hamiltonian kinetic energy K(r):  0.2423085247E+06
 Potential energy density V(r): -0.2423173169E+06
 Energy density E(r) or H(r): -0.2423085247E+06
 Laplacian of electron density: -0.9691989298E+06
 Electron localization function (ELF):  0.9999989646E+00
 Localized orbital locator (LOL):  0.9989834784E+00
 Local information entropy:  0.3498568899E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1222032892E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213970753E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1193004400E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1120801022E+05
 Wavefunction value for orbital         1 : -0.2720965930E-05
 Average local ionization energy (ALIE):  0.1021182593E+02
 Delta-g (under promolecular approximation):  0.4724415238E-01
 Delta-g (under Hirshfeld partition):  0.6252444605E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5822692134E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4681755244E-10  0.5533788532E-10  0.8021968506E-12
 Norm of gradient is:  0.7249005647E-10
 
 Components of Laplacian in x/y/z are:
 -0.3230661151E+06 -0.3230655314E+06 -0.3230672833E+06
 Total: -0.9691989298E+06
 
 Hessian matrix:
 -0.3230661151E+06 -0.4186408482E+00  0.8829097939E+00
 -0.4186408482E+00 -0.3230655314E+06  0.8728108259E+00
  0.8829097939E+00  0.8728108259E+00 -0.3230672833E+06
 Eigenvalues of Hessian: -0.3230681193E+06 -0.3230656442E+06 -0.3230651664E+06
 Eigenvectors(columns) of Hessian:
 -0.4379154409E+00 -0.8947172170E+00 -0.8781325823E-01
 -0.3501089006E+00  0.7975854938E-01  0.9333072010E+00
  0.8280421634E+00 -0.4394538377E+00  0.3481759615E+00
 Determinant of Hessian: -0.3371902541E+17
 Ellipticity of electron density:    0.000008
 eta index:   -1.000009
 
 ----------------   CP    85,     Type (3,-3)   ----------------
 Corresponding nucleus:    84(H )
 Position (Bohr):        0.752672948253    8.846931636926    8.020938897287
 Position (Angstrom):    0.398297371478    4.681594608678    4.244498074490
 Density of all electrons:  0.4400574865E+00
 Density of Alpha electrons:  0.2200287432E+00
 Density of Beta electrons:  0.2200287432E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6838121367E-02
 G(r) in X,Y,Z:  0.2593552798E-02  0.2724628699E-02  0.1519939871E-02
 Hamiltonian kinetic energy K(r):  0.6617948468E+01
 Potential energy density V(r): -0.6624786590E+01
 Energy density E(r) or H(r): -0.6617948468E+01
 Laplacian of electron density: -0.2644444139E+02
 Electron localization function (ELF):  0.9999122455E+00
 Localized orbital locator (LOL):  0.9907322250E+00
 Local information entropy:  0.6505605603E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4400574865E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2979438322E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8587019545E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1758726279E+00
 Wavefunction value for orbital         1 : -0.8743603683E-06
 Average local ionization energy (ALIE):  0.5074947536E+00
 Delta-g (under promolecular approximation):  0.1106209270E+00
 Delta-g (under Hirshfeld partition):  0.1931032515E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7600899532E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4701735895E-15  0.1160148205E-15  0.3443751360E-14
 Norm of gradient is:  0.3477635127E-14
 
 Components of Laplacian in x/y/z are:
 -0.8924265438E+01 -0.9039462642E+01 -0.8480713308E+01
 Total: -0.2644444139E+02
 
 Hessian matrix:
 -0.8924265438E+01 -0.1090624965E-01  0.2540822906E+00
 -0.1090624965E-01 -0.9039462642E+01 -0.2212035270E-01
  0.2540822906E+00 -0.2212035270E-01 -0.8480713308E+01
 Eigenvalues of Hessian: -0.9040889152E+01 -0.9039220139E+01 -0.8364332097E+01
 Eigenvectors(columns) of Hessian:
 -0.5237804406E+00 -0.7447443007E+00  0.4135335254E+00
 -0.8268375059E+00  0.5612560510E+00 -0.3648813695E-01
  0.2049238614E+00  0.3610368012E+00  0.9097574618E+00
 Determinant of Hessian: -0.6835548600E+03
 Ellipticity of electron density:    0.000185
 eta index:   -1.080886
 
 ----------------   CP    86,     Type (3,-3)   ----------------
 Corresponding nucleus:    72(C )
 Position (Bohr):       -0.085400782279    8.936635208395    6.164624746005
 Position (Angstrom):   -0.045192147776    4.729063694436    3.262178929355
 Density of all electrons:  0.1219958954E+03
 Density of Alpha electrons:  0.6099794768E+02
 Density of Beta electrons:  0.6099794768E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8779264590E+01
 G(r) in X,Y,Z:  0.2944117710E+01  0.2862959185E+01  0.2972187695E+01
 Hamiltonian kinetic energy K(r):  0.2418590028E+06
 Potential energy density V(r): -0.2418677821E+06
 Energy density E(r) or H(r): -0.2418590028E+06
 Laplacian of electron density: -0.9674008942E+06
 Electron localization function (ELF):  0.9999989618E+00
 Localized orbital locator (LOL):  0.9989820997E+00
 Local information entropy:  0.3497021609E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1219958954E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213947143E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3930048099E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7090695325E+04
 Wavefunction value for orbital         1 : -0.5722772372E-06
 Average local ionization energy (ALIE):  0.1018649120E+02
 Delta-g (under promolecular approximation):  0.3874212501E-01
 Delta-g (under Hirshfeld partition):  0.5172246104E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.9087808362E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1959161322E-12  0.5331849677E-11  0.1397807265E-09
 Norm of gradient is:  0.1398825168E-09
 
 Components of Laplacian in x/y/z are:
 -0.3224668936E+06 -0.3224672169E+06 -0.3224667838E+06
 Total: -0.9674008942E+06
 
 Hessian matrix:
 -0.3224668936E+06 -0.3019713352E+00 -0.6746045309E-01
 -0.3019713352E+00 -0.3224672169E+06 -0.1208538678E+00
 -0.6746045309E-01 -0.1208538678E+00 -0.3224667838E+06
 Eigenvalues of Hessian: -0.3224674275E+06 -0.3224667544E+06 -0.3224667123E+06
 Eigenvectors(columns) of Hessian:
 -0.5013324033E+00 -0.1922157791E+00  0.8436343495E+00
 -0.8393539917E+00 -0.1287376950E+00 -0.5281207083E+00
 -0.2101206750E+00  0.9728718827E+00  0.9679670347E-01
 Determinant of Hessian: -0.3353170906E+17
 Ellipticity of electron density:    0.000002
 eta index:   -1.000002
 
 ----------------   CP    87,     Type (3,-3)   ----------------
 Corresponding nucleus:    33(O )
 Position (Bohr):        6.959056787035    7.486434479573    2.819951337288
 Position (Angstrom):    3.682574261079    3.961650517509    1.492253983548
 Density of all electrons:  0.3021662321E+03
 Density of Alpha electrons:  0.1510831160E+03
 Density of Beta electrons:  0.1510831160E+03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7361753504E+02
 G(r) in X,Y,Z:  0.2644936101E+02  0.2136764775E+02  0.2580052627E+02
 Hamiltonian kinetic energy K(r):  0.1129125749E+07
 Potential energy density V(r): -0.1129199367E+07
 Energy density E(r) or H(r): -0.1129125749E+07
 Laplacian of electron density: -0.4516208528E+07
 Electron localization function (ELF):  0.9999964491E+00
 Localized orbital locator (LOL):  0.9981191600E+00
 Local information entropy:  0.2855225590E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3021662321E+03
 Sign(lambda2)*rho with promolecular approximation: -0.2923659863E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1295951975E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3389442226E+05
 Wavefunction value for orbital         1 :  0.7794099987E-06
 Average local ionization energy (ALIE):  0.1871878443E+02
 Delta-g (under promolecular approximation):  0.4323699522E-01
 Delta-g (under Hirshfeld partition):  0.6816736159E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1570665570E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3084589181E-10  0.1845479065E-09 -0.2085301012E-09
 Norm of gradient is:  0.2801681672E-09
 
 Components of Laplacian in x/y/z are:
 -0.1505395514E+07 -0.1505415042E+07 -0.1505397971E+07
 Total: -0.4516208528E+07
 
 Hessian matrix:
 -0.1505395514E+07  0.1982927164E+01 -0.4694621009E+00
  0.1982927164E+01 -0.1505415042E+07 -0.9222599631E+01
 -0.4694621009E+00 -0.9222599631E+01 -0.1505397971E+07
 Eigenvalues of Hessian: -0.1505419186E+07 -0.1505396094E+07 -0.1505393248E+07
 Eigenvectors(columns) of Hessian:
  0.6882405920E-01  0.8677114510E+00 -0.4922804959E+00
 -0.9154662417E+00 -0.1411697501E+00 -0.3768191369E+00
 -0.3964653946E+00  0.4766003980E+00  0.7846446658E+00
 Determinant of Hessian: -0.3411600703E+19
 Ellipticity of electron density:    0.000015
 eta index:   -1.000017
 
 ----------------   CP    88,     Type (3,-3)   ----------------
 Corresponding nucleus:     9(C )
 Position (Bohr):       -3.654151746802    7.775260338268   -2.346302886075
 Position (Angstrom):   -1.933693829589    4.114490579849   -1.241610017187
 Density of all electrons:  0.1222174629E+03
 Density of Alpha electrons:  0.6110873144E+02
 Density of Beta electrons:  0.6110873144E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8657526226E+01
 G(r) in X,Y,Z:  0.3063471951E+01  0.2875363771E+01  0.2718690504E+01
 Hamiltonian kinetic energy K(r):  0.2423390600E+06
 Potential energy density V(r): -0.2423477176E+06
 Energy density E(r) or H(r): -0.2423390600E+06
 Laplacian of electron density: -0.9693216100E+06
 Electron localization function (ELF):  0.9999989964E+00
 Localized orbital locator (LOL):  0.9989992285E+00
 Local information entropy:  0.3498674371E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1222174629E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213929343E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6453989107E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8661374961E+04
 Wavefunction value for orbital         1 :  0.3658335913E-05
 Average local ionization energy (ALIE):  0.1023503336E+02
 Delta-g (under promolecular approximation):  0.3035764650E-01
 Delta-g (under Hirshfeld partition):  0.4071172841E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.3135287783E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5447291489E-10  0.8940857516E-10  0.2884349704E-10
 Norm of gradient is:  0.1085962204E-09
 
 Components of Laplacian in x/y/z are:
 -0.3231066441E+06 -0.3231072783E+06 -0.3231076876E+06
 Total: -0.9693216100E+06
 
 Hessian matrix:
 -0.3231066441E+06  0.5016054565E+00  0.9694777330E+00
  0.5016054565E+00 -0.3231072783E+06  0.7520108461E+00
  0.9694777330E+00  0.7520108461E+00 -0.3231076876E+06
 Eigenvalues of Hessian: -0.3231084383E+06 -0.3231075290E+06 -0.3231056427E+06
 Eigenvectors(columns) of Hessian:
  0.3465464188E+00  0.5940400538E+00 -0.7259628049E+00
  0.4001497494E+00 -0.7935897181E+00 -0.4583617976E+00
 -0.8484018846E+00 -0.1316501950E+00 -0.5127206534E+00
 Determinant of Hessian: -0.3373183139E+17
 Ellipticity of electron density:    0.000003
 eta index:   -1.000009
 
 ----------------   CP    89,     Type (3,-3)   ----------------
 Corresponding nucleus:    32(O )
 Position (Bohr):       -8.081077562091    8.941940585611   -0.389618865613
 Position (Angstrom):   -4.276322085398    4.731871179154   -0.206177424620
 Density of all electrons:  0.3021735479E+03
 Density of Alpha electrons:  0.1510867739E+03
 Density of Beta electrons:  0.1510867739E+03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7354161272E+02
 G(r) in X,Y,Z:  0.2332080716E+02  0.2524076470E+02  0.2498004086E+02
 Hamiltonian kinetic energy K(r):  0.1129150310E+07
 Potential energy density V(r): -0.1129223852E+07
 Energy density E(r) or H(r): -0.1129150310E+07
 Laplacian of electron density: -0.4516307074E+07
 Electron localization function (ELF):  0.9999964567E+00
 Localized orbital locator (LOL):  0.9981211717E+00
 Local information entropy:  0.2855139721E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3021735479E+03
 Sign(lambda2)*rho with promolecular approximation: -0.2923660702E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.7977318570E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2980372926E+05
 Wavefunction value for orbital         1 :  0.3020963194E-05
 Average local ionization energy (ALIE):  0.1872038869E+02
 Delta-g (under promolecular approximation):  0.4273432410E-01
 Delta-g (under Hirshfeld partition):  0.6734719573E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1590245310E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1026413600E-08  0.1109733667E-08 -0.2771742688E-10
 Norm of gradient is:  0.1511886882E-08
 
 Components of Laplacian in x/y/z are:
 -0.1505440295E+07 -0.1505432911E+07 -0.1505433868E+07
 Total: -0.4516307074E+07
 
 Hessian matrix:
 -0.1505440295E+07 -0.7114565611E+01  0.9826483400E+01
 -0.7114565611E+01 -0.1505432911E+07  0.5905179017E+01
  0.9826483400E+01  0.5905179017E+01 -0.1505433868E+07
 Eigenvalues of Hessian: -0.1505451905E+07 -0.1505428589E+07 -0.1505426580E+07
 Eigenvectors(columns) of Hessian:
  0.7219040829E+00  0.5073071228E+00 -0.4706314676E+00
  0.4371751865E+00 -0.8615463766E+00 -0.2581001692E+00
 -0.5364068898E+00 -0.1942483365E-01 -0.8437359328E+00
 Determinant of Hessian: -0.3411824037E+19
 Ellipticity of electron density:    0.000015
 eta index:   -1.000017
 
 ----------------   CP    90,     Type (3,-3)   ----------------
 Corresponding nucleus:    41(H )
 Position (Bohr):        3.241753710601    7.986643624463    0.681666277802
 Position (Angstrom):    1.715462187010    4.226349797670    0.360722259654
 Density of all electrons:  0.4358844344E+00
 Density of Alpha electrons:  0.2179422172E+00
 Density of Beta electrons:  0.2179422172E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6577661522E-02
 G(r) in X,Y,Z:  0.2455916134E-02  0.1454353543E-02  0.2667391845E-02
 Hamiltonian kinetic energy K(r):  0.6524350175E+01
 Potential energy density V(r): -0.6530927837E+01
 Energy density E(r) or H(r): -0.6524350175E+01
 Laplacian of electron density: -0.2607109006E+02
 Electron localization function (ELF):  0.9999161729E+00
 Localized orbital locator (LOL):  0.9909406237E+00
 Local information entropy:  0.6452712297E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4358844344E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2979674220E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3188199536E-08
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2399464632E+00
 Wavefunction value for orbital         1 :  0.1099026210E-05
 Average local ionization energy (ALIE):  0.5533603738E+00
 Delta-g (under promolecular approximation):  0.1165197463E+00
 Delta-g (under Hirshfeld partition):  0.2070936864E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8230774851E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4168757353E-15  0.3442856894E-14 -0.5182486384E-16
 Norm of gradient is:  0.3468390806E-14
 
 Components of Laplacian in x/y/z are:
 -0.8918151293E+01 -0.8382136475E+01 -0.8770802288E+01
 Total: -0.2607109006E+02
 
 Hessian matrix:
 -0.8918151293E+01  0.1435182136E+00  0.7865022533E-01
  0.1435182136E+00 -0.8382136475E+01  0.3203412514E+00
  0.7865022533E-01  0.3203412514E+00 -0.8770802288E+01
 Eigenvalues of Hessian: -0.8954704200E+01 -0.8950207695E+01 -0.8166178160E+01
 Eigenvectors(columns) of Hessian:
 -0.8690446007E+00 -0.4467027747E+00  0.2126455104E+00
  0.3889152258E+00 -0.3511753666E+00  0.8517163900E+00
 -0.3057882096E+00  0.8228806068E+00  0.4789165667E+00
 Determinant of Hessian: -0.6544902912E+03
 Ellipticity of electron density:    0.000502
 eta index:   -1.096560
 
 ----------------   CP    91,     Type (3,-3)   ----------------
 Corresponding nucleus:    83(H )
 Position (Bohr):        1.397348267813    9.348167295681    4.829055876005
 Position (Angstrom):    0.739444859022    4.946837096583    2.555426319759
 Density of all electrons:  0.4407407900E+00
 Density of Alpha electrons:  0.2203703950E+00
 Density of Beta electrons:  0.2203703950E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6886654827E-02
 G(r) in X,Y,Z:  0.2038376111E-02  0.2676440188E-02  0.2171838528E-02
 Hamiltonian kinetic energy K(r):  0.6641089219E+01
 Potential energy density V(r): -0.6647975874E+01
 Energy density E(r) or H(r): -0.6641089219E+01
 Laplacian of electron density: -0.2653681026E+02
 Electron localization function (ELF):  0.9999114564E+00
 Localized orbital locator (LOL):  0.9906909397E+00
 Local information entropy:  0.6514258445E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4407407900E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2981309945E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4378014303E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1989540735E+00
 Wavefunction value for orbital         1 :  0.3263071283E-06
 Average local ionization energy (ALIE):  0.5073000500E+00
 Delta-g (under promolecular approximation):  0.1109620817E+00
 Delta-g (under Hirshfeld partition):  0.1938511869E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8032509143E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5133756579E-15  0.3176612415E-14 -0.1066136654E-14
 Norm of gradient is:  0.3389847839E-14
 
 Components of Laplacian in x/y/z are:
 -0.8711052797E+01 -0.9042742142E+01 -0.8783015318E+01
 Total: -0.2653681026E+02
 
 Hessian matrix:
 -0.8711052797E+01  0.1021530682E+00 -0.3229056351E+00
  0.1021530682E+00 -0.9042742142E+01 -0.9241369293E-01
 -0.3229056351E+00 -0.9241369293E-01 -0.8783015318E+01
 Eigenvalues of Hessian: -0.9072677773E+01 -0.9071203273E+01 -0.8392929211E+01
 Eigenvectors(columns) of Hessian:
 -0.3614395577E+00 -0.5814608256E+00 -0.7288791083E+00
 -0.6928421544E+00  0.6906266023E+00 -0.2073756138E+00
 -0.6239640977E+00 -0.4300444215E+00  0.6524803448E+00
 Determinant of Hessian: -0.6907389496E+03
 Ellipticity of electron density:    0.000163
 eta index:   -1.080991
 
 ----------------   CP    92,     Type (3,-3)   ----------------
 Corresponding nucleus:    10(C )
 Position (Bohr):       -1.302166892447    8.043586478273   -1.308225684383
 Position (Angstrom):   -0.689077044275    4.256482658229   -0.692283218894
 Density of all electrons:  0.1222089788E+03
 Density of Alpha electrons:  0.6110448941E+02
 Density of Beta electrons:  0.6110448941E+02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8759757677E+01
 G(r) in X,Y,Z:  0.3117085581E+01  0.3058725467E+01  0.2583946629E+01
 Hamiltonian kinetic energy K(r):  0.2423179699E+06
 Potential energy density V(r): -0.2423267297E+06
 Energy density E(r) or H(r): -0.2423179699E+06
 Laplacian of electron density: -0.9692368407E+06
 Electron localization function (ELF):  0.9999989724E+00
 Localized orbital locator (LOL):  0.9989873059E+00
 Local information entropy:  0.3498611242E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1222089788E+03
 Sign(lambda2)*rho with promolecular approximation: -0.1213973953E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5473379150E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9346008290E+04
 Wavefunction value for orbital         1 : -0.3977629890E-05
 Average local ionization energy (ALIE):  0.1021680039E+02
 Delta-g (under promolecular approximation):  0.4848731777E-01
 Delta-g (under Hirshfeld partition):  0.6377635968E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7809232834E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3397475530E-10 -0.6312705567E-11 -0.5085602078E-11
 Norm of gradient is:  0.3492846401E-10
 
 Components of Laplacian in x/y/z are:
 -0.3230783089E+06 -0.3230784784E+06 -0.3230800534E+06
 Total: -0.9692368407E+06
 
 Hessian matrix:
 -0.3230783089E+06 -0.2501908808E+00  0.9397438033E+00
 -0.2501908808E+00 -0.3230784784E+06  0.1082442201E+01
  0.9397438033E+00  0.1082442201E+01 -0.3230800534E+06
 Eigenvalues of Hessian: -0.3230809489E+06 -0.3230781383E+06 -0.3230777536E+06
 Eigenvectors(columns) of Hessian:
 -0.3403751456E+00  0.6936650740E+00  0.6348019576E+00
 -0.4060703712E+00 -0.7173521013E+00  0.5661385135E+00
  0.8480870320E+00 -0.6507478756E-01  0.5258456600E+00
 Determinant of Hessian: -0.3372298240E+17
 Ellipticity of electron density:    0.000009
 eta index:   -1.000010
 
 ----------------   CP    93,     Type (3,-3)   ----------------
 Corresponding nucleus:    85(H )
 Position (Bohr):       -1.398353090306   10.492010214224    6.144237280651
 Position (Angstrom):   -0.739976588186    5.552132701929    3.251390347301
 Density of all electrons:  0.4403413621E+00
 Density of Alpha electrons:  0.2201706810E+00
 Density of Beta electrons:  0.2201706810E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6809699166E-02
 G(r) in X,Y,Z:  0.2099999933E-02  0.1802941226E-02  0.2906758007E-02
 Hamiltonian kinetic energy K(r):  0.6621640807E+01
 Potential energy density V(r): -0.6628450506E+01
 Energy density E(r) or H(r): -0.6621640807E+01
 Laplacian of electron density: -0.2645932443E+02
 Electron localization function (ELF):  0.9999131592E+00
 Localized orbital locator (LOL):  0.9907802136E+00
 Local information entropy:  0.6509200663E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4403413621E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2979997906E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4811931528E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1720396145E+00
 Wavefunction value for orbital         1 : -0.2101345955E-06
 Average local ionization energy (ALIE):  0.5086553689E+00
 Delta-g (under promolecular approximation):  0.1112754714E+00
 Delta-g (under Hirshfeld partition):  0.1945892891E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.7588662213E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4957673252E-15 -0.5620306174E-14  0.1938248129E-14
 Norm of gradient is:  0.5965771747E-14
 
 Components of Laplacian in x/y/z are:
 -0.8768488140E+01 -0.8644367265E+01 -0.9046469027E+01
 Total: -0.2645932443E+02
 
 Hessian matrix:
 -0.8768488140E+01 -0.3358840599E+00  0.3632291720E-02
 -0.3358840599E+00 -0.8644367265E+01 -0.4899606623E-02
  0.3632291720E-02 -0.4899606623E-02 -0.9046469027E+01
 Eigenvalues of Hessian: -0.9048072531E+01 -0.9046447918E+01 -0.8364803983E+01
 Eigenvectors(columns) of Hessian:
  0.7493603866E+00 -0.1712953448E+00 -0.6396224792E+00
  0.6260866169E+00 -0.1311955126E+00  0.7686372913E+00
  0.2155795889E+00  0.9764454119E+00 -0.8933002877E-02
 Determinant of Hessian: -0.6846836054E+03
 Ellipticity of electron density:    0.000180
 eta index:   -1.081684
 
 ----------------   CP    94,     Type (3,-3)   ----------------
 Corresponding nucleus:    43(H )
 Position (Bohr):       -0.800395710137    9.705021729410   -0.289538895681
 Position (Angstrom):   -0.423551169509    5.135676330522   -0.153217385264
 Density of all electrons:  0.4350584170E+00
 Density of Alpha electrons:  0.2175292085E+00
 Density of Beta electrons:  0.2175292085E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6114879518E-02
 G(r) in X,Y,Z:  0.2145949063E-02  0.1584920116E-02  0.2384010339E-02
 Hamiltonian kinetic energy K(r):  0.6514069584E+01
 Potential energy density V(r): -0.6520184464E+01
 Energy density E(r) or H(r): -0.6514069584E+01
 Laplacian of electron density: -0.2603181882E+02
 Electron localization function (ELF):  0.9999270765E+00
 Localized orbital locator (LOL):  0.9915461805E+00
 Local information entropy:  0.6442232541E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4350584170E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2976865024E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5425593301E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2126347720E+00
 Wavefunction value for orbital         1 :  0.1322959711E-07
 Average local ionization energy (ALIE):  0.5580493019E+00
 Delta-g (under promolecular approximation):  0.1154821553E+00
 Delta-g (under Hirshfeld partition):  0.2048585775E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.8033293635E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5489451125E-15 -0.5893980508E-14  0.3855965026E-15
 Norm of gradient is:  0.5932034358E-14
 
 Components of Laplacian in x/y/z are:
 -0.8892121588E+01 -0.8403251552E+01 -0.8736445679E+01
 Total: -0.2603181882E+02
 
 Hessian matrix:
 -0.8892121588E+01  0.1583164763E+00  0.9545725602E-01
  0.1583164763E+00 -0.8403251552E+01  0.3258464944E+00
  0.9545725602E-01  0.3258464944E+00 -0.8736445679E+01
 Eigenvalues of Hessian: -0.8939052623E+01 -0.8935394947E+01 -0.8157371250E+01
 Eigenvectors(columns) of Hessian:
 -0.9125768220E+00 -0.3281292097E+00  0.2439974707E+00
  0.3723791635E+00 -0.4203733453E+00  0.8274176752E+00
 -0.1689298749E+00  0.8459417665E+00  0.5058114521E+00
 Determinant of Hessian: -0.6515615909E+03
 Ellipticity of electron density:    0.000409
 eta index:   -1.095825
 
 ----------------   CP    95,     Type (3,-3)   ----------------
 Corresponding nucleus:    27(S )
 Position (Bohr):       -6.031968059155   10.195134859578   -1.910552787577
 Position (Angstrom):   -3.191980033800    5.395033029772   -1.011020995413
 Density of all electrons:  0.2570182378E+04
 Density of Alpha electrons:  0.1285091189E+04
 Density of Beta electrons:  0.1285091189E+04
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.9711180343E+04
 G(r) in X,Y,Z:  0.3236952829E+04  0.3237116186E+04  0.3237111328E+04
 Hamiltonian kinetic energy K(r):  0.2868694974E+08
 Potential energy density V(r): -0.2869666092E+08
 Energy density E(r) or H(r): -0.2868694974E+08
 Laplacian of electron density: -0.1147089542E+09
 Electron localization function (ELF):  0.9999508143E+00
 Localized orbital locator (LOL):  0.9930354200E+00
 Local information entropy: -0.9228442145E+01
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2570182378E+04
 Sign(lambda2)*rho with promolecular approximation: -0.2661172831E+04
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.7887900747E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7607517665E+06
 Wavefunction value for orbital         1 : -0.3033720991E-05
 Average local ionization energy (ALIE):  0.8382164002E+02
 Delta-g (under promolecular approximation):  0.2542183598E-01
 Delta-g (under Hirshfeld partition):  0.1544862655E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1885189527E+09
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5871982437E-08  0.7559070673E-08 -0.3478400247E-08
 Norm of gradient is:  0.1018425233E-07
 
 Components of Laplacian in x/y/z are:
 -0.3823631856E+08 -0.3823631792E+08 -0.3823631774E+08
 Total: -0.1147089542E+09
 
 Hessian matrix:
 -0.3823631856E+08  0.1253430233E+01  0.1126492020E+01
  0.1253430233E+01 -0.3823631792E+08  0.6176404881E+00
  0.1126492020E+01  0.6176404881E+00 -0.3823631774E+08
 Eigenvalues of Hessian: -0.3823631971E+08 -0.3823631844E+08 -0.3823631607E+08
 Eigenvectors(columns) of Hessian:
 -0.8238160775E+00 -0.8643631423E-01  0.5602283767E+00
  0.4639526384E+00 -0.6706520025E+00  0.5787692467E+00
  0.3256916022E+00  0.7367188440E+00  0.5925962581E+00
 Determinant of Hessian: -0.5590210956E+23
 Ellipticity of electron density:    0.000000
 eta index:   -1.000000
 
 ----------------   CP    96,     Type (3,-3)   ----------------
 Corresponding nucleus:    30(O )
 Position (Bohr):       -6.895779167121   10.913635714433   -4.518767050369
 Position (Angstrom):   -3.649089186660    5.775247308175   -2.391228544435
 Density of all electrons:  0.3021699617E+03
 Density of Alpha electrons:  0.1510849809E+03
 Density of Beta electrons:  0.1510849809E+03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7355964097E+02
 G(r) in X,Y,Z:  0.2607449670E+02  0.2619501042E+02  0.2129013384E+02
 Hamiltonian kinetic energy K(r):  0.1129132558E+07
 Potential energy density V(r): -0.1129206117E+07
 Energy density E(r) or H(r): -0.1129132558E+07
 Laplacian of electron density: -0.4516235992E+07
 Electron localization function (ELF):  0.9999964548E+00
 Localized orbital locator (LOL):  0.9981206749E+00
 Local information entropy:  0.2855181814E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3021699617E+03
 Sign(lambda2)*rho with promolecular approximation: -0.2923660218E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.9735576009E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2627573409E+05
 Wavefunction value for orbital         1 :  0.2105807752E-05
 Average local ionization energy (ALIE):  0.1872076141E+02
 Delta-g (under promolecular approximation):  0.4298333027E-01
 Delta-g (under Hirshfeld partition):  0.6773713861E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1583387100E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5308726544E-09 -0.8370308327E-09 -0.2110546249E-09
 Norm of gradient is:  0.1013405370E-08
 
 Components of Laplacian in x/y/z are:
 -0.1505406000E+07 -0.1505405545E+07 -0.1505424447E+07
 Total: -0.4516235992E+07
 
 Hessian matrix:
 -0.1505406000E+07  0.2847339215E+01 -0.6607514709E+01
  0.2847339215E+01 -0.1505405545E+07  0.5404437945E+01
 -0.6607514709E+01  0.5404437945E+01 -0.1505424447E+07
 Eigenvalues of Hessian: -0.1505428172E+07 -0.1505404933E+07 -0.1505402887E+07
 Eigenvectors(columns) of Hessian:
  0.3061836114E+00 -0.6025294299E+00  0.7370277350E+00
 -0.2574308457E+00  0.6929614097E+00  0.6734492144E+00
  0.9165047495E+00  0.3959327857E+00 -0.5706376629E-01
 Determinant of Hessian: -0.3411662943E+19
 Ellipticity of electron density:    0.000015
 eta index:   -1.000017
 
 ----------------   CP    97,     Type (3,-3)   ----------------
 Corresponding nucleus:    31(O )
 Position (Bohr):       -4.772643497707   12.324884417902   -0.526329018333
 Position (Angstrom):   -2.525574174751    6.522047960967   -0.278521321939
 Density of all electrons:  0.3021669665E+03
 Density of Alpha electrons:  0.1510834832E+03
 Density of Beta electrons:  0.1510834832E+03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7357735829E+02
 G(r) in X,Y,Z:  0.2528387452E+02  0.2296059602E+02  0.2533288775E+02
 Hamiltonian kinetic energy K(r):  0.1129124550E+07
 Potential energy density V(r): -0.1129198127E+07
 Energy density E(r) or H(r): -0.1129124550E+07
 Laplacian of electron density: -0.4516203891E+07
 Electron localization function (ELF):  0.9999964530E+00
 Localized orbital locator (LOL):  0.9981201921E+00
 Local information entropy:  0.2855216970E+00
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3021669665E+03
 Sign(lambda2)*rho with promolecular approximation: -0.2923658572E+03
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1741420058E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2717045230E+05
 Wavefunction value for orbital         1 :  0.2459670844E-05
 Average local ionization energy (ALIE):  0.1872188649E+02
 Delta-g (under promolecular approximation):  0.4345063280E-01
 Delta-g (under Hirshfeld partition):  0.6848362924E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.1562057012E+07
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4453492068E-09 -0.1180333922E-08  0.6832163877E-11
 Norm of gradient is:  0.1261574715E-08
 
 Components of Laplacian in x/y/z are:
 -0.1505398415E+07 -0.1505407320E+07 -0.1505398156E+07
 Total: -0.4516203891E+07
 
 Hessian matrix:
 -0.1505398415E+07 -0.7214589454E+01 -0.5308029737E+01
 -0.7214589454E+01 -0.1505407320E+07 -0.9360223663E+01
 -0.5308029737E+01 -0.9360223663E+01 -0.1505398156E+07
 Eigenvalues of Hessian: -0.1505417371E+07 -0.1505394392E+07 -0.1505392128E+07
 Eigenvectors(columns) of Hessian:
 -0.4265102608E+00  0.8653784181E+00 -0.2630763975E+00
 -0.7611620321E+00 -0.5005277175E+00 -0.4124371042E+00
 -0.4885911976E+00  0.2433510840E-01  0.8721734026E+00
 Determinant of Hessian: -0.3411590195E+19
 Ellipticity of electron density:    0.000015
 eta index:   -1.000017
 
 ----------------   CP    98,     Type (3,-1)   ----------------
 Connected atoms:    96(H )   --    77(C )
 Position (Bohr):       -4.473219115463  -12.716753902477   -0.074688423959
 Position (Angstrom):   -2.367125615279   -6.729416361853   -0.039523411878
 Density of all electrons:  0.2766003468E+00
 Density of Alpha electrons:  0.1383001734E+00
 Density of Beta electrons:  0.1383001734E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4193126218E-01
 G(r) in X,Y,Z:  0.9395134404E-02  0.1502483800E-01  0.1751128979E-01
 Hamiltonian kinetic energy K(r):  0.2769231059E+00
 Potential energy density V(r): -0.3188543681E+00
 Energy density E(r) or H(r): -0.2769231059E+00
 Laplacian of electron density: -0.9399673749E+00
 Electron localization function (ELF):  0.9847606157E+00
 Localized orbital locator (LOL):  0.8893871315E+00
 Local information entropy:  0.4361237713E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2766003468E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1798986451E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1478263484E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5548662269E-02
 Wavefunction value for orbital         1 : -0.4859214031E-06
 Average local ionization energy (ALIE):  0.5393998541E+00
 Delta-g (under promolecular approximation):  0.2927541581E+00
 Delta-g (under Hirshfeld partition):  0.5081055581E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4026607324E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3932806797E-15 -0.6070651252E-15  0.2800445507E-15
 Norm of gradient is:  0.7756434165E-15
 
 Components of Laplacian in x/y/z are:
  0.5100289204E-01 -0.4249043536E+00 -0.5660659133E+00
 Total: -0.9399673749E+00
 
 Hessian matrix:
  0.5100289204E-01  0.4783436795E+00 -0.3414380998E+00
  0.4783436795E+00 -0.4249043536E+00 -0.2143890090E+00
 -0.3414380998E+00 -0.2143890090E+00 -0.5660659133E+00
 Eigenvalues of Hessian: -0.7225367816E+00 -0.7172334921E+00  0.4998028989E+00
 Eigenvectors(columns) of Hessian:
  0.3062945953E+00  0.5239651406E+00 -0.7947604371E+00
 -0.8291360928E+00 -0.2633251612E+00 -0.4931462248E+00
 -0.4676718512E+00  0.8100125869E+00  0.3537833357E+00
 Determinant of Hessian:  0.2590116463E+00
 Ellipticity of electron density:    0.007394
 eta index:    1.445643
 
 ----------------   CP    99,     Type (3,-1)   ----------------
 Connected atoms:    94(H )   --    77(C )
 Position (Bohr):       -2.347753894037  -12.709990684161   -0.136933563221
 Position (Angstrom):   -1.242377857533   -6.725837420848   -0.072462121064
 Density of all electrons:  0.2756282124E+00
 Density of Alpha electrons:  0.1378141062E+00
 Density of Beta electrons:  0.1378141062E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4211927150E-01
 G(r) in X,Y,Z:  0.8886839540E-02  0.1519840765E-01  0.1803402432E-01
 Hamiltonian kinetic energy K(r):  0.2753591660E+00
 Potential energy density V(r): -0.3174784375E+00
 Energy density E(r) or H(r): -0.2753591660E+00
 Laplacian of electron density: -0.9329595778E+00
 Electron localization function (ELF):  0.9844471177E+00
 Localized orbital locator (LOL):  0.8883656367E+00
 Local information entropy:  0.4347965772E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2756282124E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1795279698E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1364381469E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5743780005E-02
 Wavefunction value for orbital         1 :  0.1481652945E-05
 Average local ionization energy (ALIE):  0.5391605839E+00
 Delta-g (under promolecular approximation):  0.2914121236E+00
 Delta-g (under Hirshfeld partition):  0.5059781111E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4083656766E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1924629533E-14 -0.4859832477E-15  0.6981869841E-15
 Norm of gradient is:  0.2104244193E-14
 
 Components of Laplacian in x/y/z are:
  0.9407608050E-01 -0.4265696700E+00 -0.6004659883E+00
 Total: -0.9329595778E+00
 
 Hessian matrix:
  0.9407608050E-01 -0.4841343653E+00  0.3016441137E+00
 -0.4841343653E+00 -0.4265696700E+00 -0.1834006060E+00
  0.3016441137E+00 -0.1834006060E+00 -0.6004659883E+00
 Eigenvalues of Hessian: -0.7176914546E+00 -0.7122588475E+00  0.4969907243E+00
 Eigenvectors(columns) of Hessian:
  0.2728045159E+00  0.5083672911E+00 -0.8167866266E+00
  0.7949992755E+00  0.3590034498E+00  0.4889710369E+00
  0.5418060982E+00 -0.7827382834E+00 -0.3062138658E+00
 Determinant of Hessian:  0.2540527563E+00
 Ellipticity of electron density:    0.007627
 eta index:    1.444074
 
 ----------------   CP   100,     Type (3,-1)   ----------------
 Connected atoms:    77(C )   --    95(H )
 Position (Bohr):       -3.463472740483  -12.146844158207   -1.857471952942
 Position (Angstrom):   -1.832790844847   -6.427833112914   -0.982931827389
 Density of all electrons:  0.2756458554E+00
 Density of Alpha electrons:  0.1378229277E+00
 Density of Beta electrons:  0.1378229277E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4204921106E-01
 G(r) in X,Y,Z:  0.1977341461E-01  0.1856338251E-01  0.3712413940E-02
 Hamiltonian kinetic energy K(r):  0.2753766308E+00
 Potential energy density V(r): -0.3174258419E+00
 Energy density E(r) or H(r): -0.2753766308E+00
 Laplacian of electron density: -0.9333096789E+00
 Electron localization function (ELF):  0.9845012578E+00
 Localized orbital locator (LOL):  0.8885411940E+00
 Local information entropy:  0.4348206705E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2756458554E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1795306796E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8029873729E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5817457283E-02
 Wavefunction value for orbital         1 : -0.5113713976E-06
 Average local ionization energy (ALIE):  0.5388391260E+00
 Delta-g (under promolecular approximation):  0.2916811464E+00
 Delta-g (under Hirshfeld partition):  0.5062177394E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4158336474E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4304751140E-16 -0.4326222896E-15 -0.1608373193E-14
 Norm of gradient is:  0.1666097074E-14
 
 Components of Laplacian in x/y/z are:
 -0.7119733942E+00 -0.7136528441E+00  0.4923165594E+00
 Total: -0.9333096789E+00
 
 Hessian matrix:
 -0.7119733942E+00  0.2833711596E-02  0.3507754431E-01
  0.2833711596E-02 -0.7136528441E+00  0.7519176977E-01
  0.3507754431E-01  0.7519176977E-01  0.4923165594E+00
 Eigenvalues of Hessian: -0.7184019565E+00 -0.7129175626E+00  0.4980098402E+00
 Eigenvectors(columns) of Hessian:
  0.1199810543E+00 -0.9923505638E+00  0.2906725108E-01
 -0.9910761195E+00 -0.1180115176E+00  0.6197908543E-01
  0.5807470996E-01  0.3624417442E-01  0.9976540923E+00
 Determinant of Hessian:  0.2550614029E+00
 Ellipticity of electron density:    0.007693
 eta index:    1.442546
 
 ----------------   CP   101,     Type (3,-1)   ----------------
 Connected atoms:    53(H )   --    25(C )
 Position (Bohr):      -11.808082371087   -8.379997683384    6.234807019973
 Position (Angstrom):   -6.248568095245   -4.434503801467    3.299317789348
 Density of all electrons:  0.2867629675E+00
 Density of Alpha electrons:  0.1433814837E+00
 Density of Beta electrons:  0.1433814837E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3596147124E-01
 G(r) in X,Y,Z:  0.1477812861E-01  0.8773480720E-02  0.1240986192E-01
 Hamiltonian kinetic energy K(r):  0.2928169447E+00
 Potential energy density V(r): -0.3287784159E+00
 Energy density E(r) or H(r): -0.2928169447E+00
 Laplacian of electron density: -0.1027421894E+01
 Electron localization function (ELF):  0.9900075000E+00
 Localized orbital locator (LOL):  0.9087292549E+00
 Local information entropy:  0.4499552939E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2867629675E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1808375004E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8218578209E-08
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5186224341E-02
 Wavefunction value for orbital         1 : -0.3520254761E-07
 Average local ionization energy (ALIE):  0.5631667466E+00
 Delta-g (under promolecular approximation):  0.3081217705E+00
 Delta-g (under Hirshfeld partition):  0.5361245253E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.3804159422E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.7934780318E-16 -0.3602347480E-15  0.2833318856E-15
 Norm of gradient is:  0.4651259022E-15
 
 Components of Laplacian in x/y/z are:
 -0.6419939941E+00 -0.2461829936E-01 -0.3608096003E+00
 Total: -0.1027421894E+01
 
 Hessian matrix:
 -0.6419939941E+00  0.3283886274E+00 -0.2429926270E+00
  0.3283886274E+00 -0.2461829936E-01 -0.5585428174E+00
 -0.2429926270E+00 -0.5585428174E+00 -0.3608096003E+00
 Eigenvalues of Hessian: -0.7841537743E+00 -0.7759154436E+00  0.5326473241E+00
 Eigenvectors(columns) of Hessian:
  0.9394767792E+00  0.9738730636E-01 -0.3284799750E+00
 -0.3237570486E+00  0.5660232271E+00 -0.7581550500E+00
  0.1120926174E+00  0.8186167717E+00  0.5632955052E+00
 Determinant of Hessian:  0.3240823525E+00
 Ellipticity of electron density:    0.010618
 eta index:    1.472182
 
 ----------------   CP   102,     Type (3,-1)   ----------------
 Connected atoms:    77(C )   --    76(C )
 Position (Bohr):       -3.414486367404  -10.715515949147   -0.109481870893
 Position (Angstrom):   -1.806868372569   -5.670406843356   -0.057935311084
 Density of all electrons:  0.2437410117E+00
 Density of Alpha electrons:  0.1218705059E+00
 Density of Beta electrons:  0.1218705059E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.5842089334E-01
 G(r) in X,Y,Z:  0.2605477042E-01  0.7854215442E-02  0.2451190748E-01
 Hamiltonian kinetic energy K(r):  0.2070500519E+00
 Potential energy density V(r): -0.2654709453E+00
 Energy density E(r) or H(r): -0.2070500519E+00
 Laplacian of electron density: -0.5945166343E+00
 Electron localization function (ELF):  0.9562198801E+00
 Localized orbital locator (LOL):  0.8237661936E+00
 Local information entropy:  0.3908442910E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2437410117E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1766643585E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5944253267E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.4206500308E-02
 Wavefunction value for orbital         1 :  0.3411703400E-06
 Average local ionization energy (ALIE):  0.5652445876E+00
 Delta-g (under promolecular approximation):  0.3309066720E+00
 Delta-g (under Hirshfeld partition):  0.4618059589E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4648224069E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.5211200801E-16 -0.1070675056E-15 -0.1275689852E-15
 Norm of gradient is:  0.1745077595E-15
 
 Components of Laplacian in x/y/z are:
 -0.4577795147E+00  0.2480686325E+00 -0.3848057521E+00
 Total: -0.5945166343E+00
 
 Hessian matrix:
 -0.4577795147E+00  0.4153895610E-02  0.1980392011E-02
  0.4153895610E-02  0.2480686325E+00  0.2260164284E+00
  0.1980392011E-02  0.2260164284E+00 -0.3848057521E+00
 Eigenvalues of Hessian: -0.4582012379E+00 -0.4568384701E+00  0.3205230736E+00
 Eigenvectors(columns) of Hessian:
  0.8426864258E+00 -0.5383727897E+00  0.5858936101E-02
  0.1595971881E+00  0.2601723936E+00  0.9522809791E+00
 -0.5142065007E+00 -0.8015391849E+00  0.3051665278E+00
 Determinant of Hessian:  0.6709315663E-01
 Ellipticity of electron density:    0.002983
 eta index:    1.429542
 
 ----------------   CP   103,     Type (3,-1)   ----------------
 Connected atoms:    49(H )   --    20(C )
 Position (Bohr):       -7.932495266601   -7.966674469810    5.522893584872
 Position (Angstrom):   -4.197695720681   -4.215782576106    2.922589423357
 Density of all electrons:  0.2866660735E+00
 Density of Alpha electrons:  0.1433330368E+00
 Density of Beta electrons:  0.1433330368E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3582077381E-01
 G(r) in X,Y,Z:  0.1047951006E-01  0.1071130363E-01  0.1462996012E-01
 Hamiltonian kinetic energy K(r):  0.2926279266E+00
 Potential energy density V(r): -0.3284487004E+00
 Energy density E(r) or H(r): -0.2926279266E+00
 Laplacian of electron density: -0.1027228611E+01
 Electron localization function (ELF):  0.9900736774E+00
 Localized orbital locator (LOL):  0.9090072941E+00
 Local information entropy:  0.4498237840E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2866660735E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1808248060E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1835000071E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6526089955E-02
 Wavefunction value for orbital         1 : -0.1322646493E-06
 Average local ionization energy (ALIE):  0.5642068590E+00
 Delta-g (under promolecular approximation):  0.3085096221E+00
 Delta-g (under Hirshfeld partition):  0.5362391458E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4321278317E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.7925274359E-16  0.1777869217E-15  0.1865335956E-15
 Norm of gradient is:  0.2695996461E-15
 
 Components of Laplacian in x/y/z are:
 -0.2195746854E+00 -0.2213046760E+00 -0.5863492498E+00
 Total: -0.1027228611E+01
 
 Hessian matrix:
 -0.2195746854E+00 -0.5623540110E+00  0.3306878523E+00
 -0.5623540110E+00 -0.2213046760E+00 -0.3251671048E+00
  0.3306878523E+00 -0.3251671048E+00 -0.5863492498E+00
 Eigenvalues of Hessian: -0.7845302495E+00 -0.7766031606E+00  0.5339047988E+00
 Eigenvectors(columns) of Hessian:
  0.7505149529E+00  0.9095263428E-01  0.6545646827E+00
  0.4996329145E+00  0.5702010902E+00 -0.6521024977E+00
 -0.4325439356E+00  0.8164547355E+00  0.3825015146E+00
 Determinant of Hessian:  0.3252914674E+00
 Ellipticity of electron density:    0.010207
 eta index:    1.469420
 
 ----------------   CP   104,     Type (3,-1)   ----------------
 Connected atoms:    93(H )   --    76(C )
 Position (Bohr):       -3.410521794729   -9.288987578403    1.650078386290
 Position (Angstrom):   -1.804770411059   -4.915520538852    0.873183878228
 Density of all electrons:  0.2781641661E+00
 Density of Alpha electrons:  0.1390820830E+00
 Density of Beta electrons:  0.1390820830E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4156024624E-01
 G(r) in X,Y,Z:  0.1897913727E-01  0.1864788266E-01  0.3933226314E-02
 Hamiltonian kinetic energy K(r):  0.2788903889E+00
 Potential energy density V(r): -0.3204506351E+00
 Energy density E(r) or H(r): -0.2788903889E+00
 Laplacian of electron density: -0.9493205706E+00
 Electron localization function (ELF):  0.9852997146E+00
 Localized orbital locator (LOL):  0.8911730931E+00
 Local information entropy:  0.4382572379E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2781641661E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1801076179E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2828507533E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7530405172E-02
 Wavefunction value for orbital         1 :  0.1701905256E-05
 Average local ionization energy (ALIE):  0.5421861373E+00
 Delta-g (under promolecular approximation):  0.2923847842E+00
 Delta-g (under Hirshfeld partition):  0.5112298577E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4802321662E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1560863611E-15 -0.4749713429E-15  0.1047657191E-14
 Norm of gradient is:  0.1160838627E-14
 
 Components of Laplacian in x/y/z are:
 -0.7263322097E+00 -0.7253158160E+00  0.5023274551E+00
 Total: -0.9493205706E+00
 
 Hessian matrix:
 -0.7263322097E+00 -0.1827973635E-02 -0.6976950224E-02
 -0.1827973635E-02 -0.7253158160E+00  0.4950510403E-01
 -0.6976950224E-02  0.4950510403E-01  0.5023274551E+00
 Eigenvalues of Hessian: -0.7284558600E+00 -0.7252255658E+00  0.5043608551E+00
 Eigenvectors(columns) of Hessian:
 -0.5958651946E+00 -0.8030640718E+00 -0.5724199802E-02
 -0.8025641837E+00  0.5952074978E+00  0.4023388615E-01
  0.2890330180E-01 -0.2856801014E-01  0.9991738927E+00
 Determinant of Hessian:  0.2664512237E+00
 Ellipticity of electron density:    0.004454
 eta index:    1.444315
 
 ----------------   CP   105,     Type (3,-1)   ----------------
 Connected atoms:    25(C )   --    20(C )
 Position (Bohr):      -10.089273344282   -7.241287264686    5.253287139383
 Position (Angstrom):   -5.339013528365   -3.831924198074    2.779919836491
 Density of all electrons:  0.3160576072E+00
 Density of Alpha electrons:  0.1580288036E+00
 Density of Beta electrons:  0.1580288036E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1039863827E+00
 G(r) in X,Y,Z:  0.6751761053E-02  0.4509553745E-01  0.5213908420E-01
 Hamiltonian kinetic energy K(r):  0.3363700234E+00
 Potential energy density V(r): -0.4403564060E+00
 Energy density E(r) or H(r): -0.3363700234E+00
 Laplacian of electron density: -0.9295345626E+00
 Electron localization function (ELF):  0.9425051603E+00
 Localized orbital locator (LOL):  0.8019488122E+00
 Local information entropy:  0.4894078234E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3160576072E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2191876756E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.9321654805E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5485634224E-02
 Wavefunction value for orbital         1 : -0.2987119167E-06
 Average local ionization energy (ALIE):  0.6379706962E+00
 Delta-g (under promolecular approximation):  0.3933685129E+00
 Delta-g (under Hirshfeld partition):  0.5695502465E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4486804459E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.8744815793E-16  0.3116933015E-16  0.7427340747E-16
 Norm of gradient is:  0.1188917429E-15
 
 Components of Laplacian in x/y/z are:
  0.2830471597E+00 -0.6334162535E+00 -0.5791654689E+00
 Total: -0.9295345626E+00
 
 Hessian matrix:
  0.2830471597E+00  0.1062157648E+00 -0.1694385869E+00
  0.1062157648E+00 -0.6334162535E+00  0.2485385394E-01
 -0.1694385869E+00  0.2485385394E-01 -0.5791654689E+00
 Eigenvalues of Hessian: -0.6744008048E+00 -0.5806779566E+00  0.3255441987E+00
 Eigenvectors(columns) of Hessian:
 -0.1872352108E+00 -0.9062036942E-01 -0.9781262314E+00
  0.8164637868E+00 -0.5680145528E+00 -0.1036646165E+00
 -0.5461958080E+00 -0.8180143131E+00  0.1803405745E+00
 Determinant of Hessian:  0.1274862599E+00
 Ellipticity of electron density:    0.161402
 eta index:    2.071611
 
 ----------------   CP   106,     Type (3,-1)   ----------------
 Connected atoms:    25(C )   --    24(C )
 Position (Bohr):      -12.225801019250   -6.514643370998    4.985906547644
 Position (Angstrom):   -6.469615284422   -3.447400809092    2.638428120706
 Density of all electrons:  0.3164035049E+00
 Density of Alpha electrons:  0.1582017524E+00
 Density of Beta electrons:  0.1582017524E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1043337705E+00
 G(r) in X,Y,Z:  0.2450809236E-01  0.3128538858E-01  0.4854028958E-01
 Hamiltonian kinetic energy K(r):  0.3369959778E+00
 Potential energy density V(r): -0.4413297483E+00
 Energy density E(r) or H(r): -0.3369959778E+00
 Laplacian of electron density: -0.9306488290E+00
 Electron localization function (ELF):  0.9423410953E+00
 Localized orbital locator (LOL):  0.8017085383E+00
 Local information entropy:  0.4898701143E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3164035049E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2193634792E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1432002083E-15
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5030096645E-02
 Wavefunction value for orbital         1 : -0.4149790784E-07
 Average local ionization energy (ALIE):  0.6380031157E+00
 Delta-g (under promolecular approximation):  0.3938312444E+00
 Delta-g (under Hirshfeld partition):  0.5700425488E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4304436525E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2556913212E-16  0.2565453686E-15  0.1246638740E-15
 Norm of gradient is:  0.2863745592E-15
 
 Components of Laplacian in x/y/z are:
 -0.2532331138E+00 -0.2123418885E+00 -0.4650738267E+00
 Total: -0.9306488290E+00
 
 Hessian matrix:
 -0.2532331138E+00 -0.4220588632E+00  0.2560714684E+00
 -0.4220588632E+00 -0.2123418885E+00 -0.2082342865E+00
  0.2560714684E+00 -0.2082342865E+00 -0.4650738267E+00
 Eigenvalues of Hessian: -0.6754942252E+00 -0.5807886023E+00  0.3256339985E+00
 Eigenvectors(columns) of Hessian:
  0.7553470804E+00  0.9201338452E-01  0.6488330488E+00
  0.4955146079E+00  0.5677381703E+00 -0.6573725301E+00
 -0.4288543593E+00  0.8180506751E+00  0.3832453932E+00
 Determinant of Hessian:  0.1277525176E+00
 Ellipticity of electron density:    0.163064
 eta index:    2.074397
 
 ----------------   CP   107,     Type (3,-1)   ----------------
 Connected atoms:    76(C )   --    92(H )
 Position (Bohr):       -4.507769255823   -8.729508416941   -0.072737489669
 Position (Angstrom):   -2.385408762191   -4.619456916631   -0.038491021911
 Density of all electrons:  0.2796480143E+00
 Density of Alpha electrons:  0.1398240071E+00
 Density of Beta electrons:  0.1398240071E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4130650202E-01
 G(r) in X,Y,Z:  0.8533261485E-02  0.1498569583E-01  0.1778754470E-01
 Hamiltonian kinetic energy K(r):  0.2812897510E+00
 Potential energy density V(r): -0.3225962531E+00
 Energy density E(r) or H(r): -0.2812897510E+00
 Laplacian of electron density: -0.9599329961E+00
 Electron localization function (ELF):  0.9857276856E+00
 Localized orbital locator (LOL):  0.8926184967E+00
 Local information entropy:  0.4402798803E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2796480143E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1805105409E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5530622934E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7775007590E-02
 Wavefunction value for orbital         1 :  0.2278636154E-06
 Average local ionization energy (ALIE):  0.5404794271E+00
 Delta-g (under promolecular approximation):  0.2949101998E+00
 Delta-g (under Hirshfeld partition):  0.5151891064E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4943656281E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3978259643E-16  0.2482636628E-15 -0.1085582836E-15
 Norm of gradient is:  0.2738656645E-15
 
 Components of Laplacian in x/y/z are:
  0.1309603729E+00 -0.4701306160E+00 -0.6207627529E+00
 Total: -0.9599329961E+00
 
 Hessian matrix:
  0.1309603729E+00 -0.4813282645E+00  0.3128718409E+00
 -0.4813282645E+00 -0.4701306160E+00 -0.1732682056E+00
  0.3128718409E+00 -0.1732682056E+00 -0.6207627529E+00
 Eigenvalues of Hessian: -0.7370505438E+00 -0.7337808156E+00  0.5108983633E+00
 Eigenvectors(columns) of Hessian:
 -0.4993978052E+00 -0.2349391576E+00 -0.8339097220E+00
 -0.8646012250E+00  0.1966701821E+00  0.4623695072E+00
  0.5537647438E-01  0.9519056842E+00 -0.3013453408E+00
 Determinant of Hessian:  0.2763109751E+00
 Ellipticity of electron density:    0.004456
 eta index:    1.442656
 
 ----------------   CP   108,     Type (3,-1)   ----------------
 Connected atoms:    76(C )   --    75(C )
 Position (Bohr):       -2.303493546830   -8.638763076441   -0.155576801788
 Position (Angstrom):   -1.218956290445   -4.571436550443   -0.082327698052
 Density of all electrons:  0.2474312057E+00
 Density of Alpha electrons:  0.1237156028E+00
 Density of Beta electrons:  0.1237156028E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.5796770451E-01
 G(r) in X,Y,Z:  0.1470964570E-01  0.1906790366E-01  0.2419015516E-01
 Hamiltonian kinetic energy K(r):  0.2118718636E+00
 Potential energy density V(r): -0.2698395681E+00
 Energy density E(r) or H(r): -0.2118718636E+00
 Laplacian of electron density: -0.6156166364E+00
 Electron localization function (ELF):  0.9588877672E+00
 Localized orbital locator (LOL):  0.8284819665E+00
 Local information entropy:  0.3959738921E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2474312057E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1761604333E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1726048691E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5478581493E-02
 Wavefunction value for orbital         1 : -0.3668323401E-06
 Average local ionization energy (ALIE):  0.5737253175E+00
 Delta-g (under promolecular approximation):  0.3137667413E+00
 Delta-g (under Hirshfeld partition):  0.4668535260E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5161826255E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1402737383E-15 -0.1994610125E-15 -0.4640681760E-16
 Norm of gradient is:  0.2482237093E-15
 
 Components of Laplacian in x/y/z are:
  0.3231159888E-01 -0.2773457706E+00 -0.3705824647E+00
 Total: -0.6156166364E+00
 
 Hessian matrix:
  0.3231159888E-01  0.3205913541E+00 -0.2173195514E+00
  0.3205913541E+00 -0.2773457706E+00 -0.1453241889E+00
 -0.2173195514E+00 -0.1453241889E+00 -0.3705824647E+00
 Eigenvalues of Hessian: -0.4821027919E+00 -0.4643820289E+00  0.3308681844E+00
 Eigenvectors(columns) of Hessian:
  0.3450724777E+00  0.5036827596E+00 -0.7919776908E+00
 -0.8389528322E+00 -0.2127969621E+00 -0.5008748329E+00
 -0.4208124647E+00  0.8372700464E+00  0.3491357028E+00
 Determinant of Hessian:  0.7407472700E-01
 Ellipticity of electron density:    0.038160
 eta index:    1.457084
 
 ----------------   CP   109,     Type (3,-1)   ----------------
 Connected atoms:    52(H )   --    24(C )
 Position (Bohr):      -14.377787680209   -5.780484286563    4.715096901909
 Position (Angstrom):   -7.608397583569   -3.058900552432    2.495121827689
 Density of all electrons:  0.2869006444E+00
 Density of Alpha electrons:  0.1434503222E+00
 Density of Beta electrons:  0.1434503222E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3578245374E-01
 G(r) in X,Y,Z:  0.3484315229E-02  0.1619159127E-01  0.1610654724E-01
 Hamiltonian kinetic energy K(r):  0.2929774684E+00
 Potential energy density V(r): -0.3287599222E+00
 Energy density E(r) or H(r): -0.2929774684E+00
 Laplacian of electron density: -0.1028780059E+01
 Electron localization function (ELF):  0.9901213909E+00
 Localized orbital locator (LOL):  0.9092083821E+00
 Local information entropy:  0.4501421448E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2869006444E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1808251890E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5587709464E-09
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5054266509E-02
 Wavefunction value for orbital         1 :  0.2241186258E-06
 Average local ionization energy (ALIE):  0.5638903463E+00
 Delta-g (under promolecular approximation):  0.3086479174E+00
 Delta-g (under Hirshfeld partition):  0.5367598843E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.3780185488E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.6275405179E-16  0.3032986392E-15 -0.3035956798E-15
 Norm of gradient is:  0.4337032077E-15
 
 Components of Laplacian in x/y/z are:
  0.4791143552E+00 -0.7696300851E+00 -0.7382643288E+00
 Total: -0.1028780059E+01
 
 Hessian matrix:
  0.4791143552E+00  0.1292970956E+00 -0.2288797044E+00
  0.1292970956E+00 -0.7696300851E+00 -0.1962588511E-01
 -0.2288797044E+00 -0.1962588511E-01 -0.7382643288E+00
 Eigenvalues of Hessian: -0.7853666021E+00 -0.7772474075E+00  0.5338339509E+00
 Eigenvectors(columns) of Hessian:
  0.1823239938E+00 -0.9104028601E-01  0.9790146207E+00
 -0.8184064748E+00 -0.5659090505E+00  0.9978871938E-01
  0.5449484409E+00 -0.8194257824E+00 -0.1776867578E+00
 Determinant of Hessian:  0.3258651386E+00
 Ellipticity of electron density:    0.010446
 eta index:    1.471181
 
 ----------------   CP   110,     Type (3,-1)   ----------------
 Connected atoms:    46(H )   --    13(C )
 Position (Bohr):        9.442004381158   -9.758636008431   -0.131964269951
 Position (Angstrom):    4.996493543755   -5.164047785159   -0.069832484311
 Density of all electrons:  0.2877939530E+00
 Density of Alpha electrons:  0.1438969765E+00
 Density of Beta electrons:  0.1438969765E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3494515175E-01
 G(r) in X,Y,Z:  0.1505572518E-01  0.3679293753E-02  0.1621013281E-01
 Hamiltonian kinetic energy K(r):  0.2942342663E+00
 Potential energy density V(r): -0.3291794180E+00
 Energy density E(r) or H(r): -0.2942342663E+00
 Laplacian of electron density: -0.1037156458E+01
 Electron localization function (ELF):  0.9906701342E+00
 Localized orbital locator (LOL):  0.9115627050E+00
 Local information entropy:  0.4513541758E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2877939530E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1807369266E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8948320059E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6077908312E-02
 Wavefunction value for orbital         1 : -0.1583104049E-06
 Average local ionization energy (ALIE):  0.5686855013E+00
 Delta-g (under promolecular approximation):  0.3113957239E+00
 Delta-g (under Hirshfeld partition):  0.5402569754E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4114528702E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3887593237E-15  0.2464001903E-15 -0.3159094080E-16
 Norm of gradient is:  0.4613511169E-15
 
 Components of Laplacian in x/y/z are:
 -0.7148788115E+00  0.4570160819E+00 -0.7792937286E+00
 Total: -0.1037156458E+01
 
 Hessian matrix:
 -0.7148788115E+00 -0.3100902052E+00  0.2111847389E-01
 -0.3100902052E+00  0.4570160819E+00 -0.8121801977E-01
  0.2111847389E-01 -0.8121801977E-01 -0.7792937286E+00
 Eigenvalues of Hessian: -0.7919878082E+00 -0.7845179289E+00  0.5393492789E+00
 Eigenvectors(columns) of Hessian:
  0.9648761573E+00  0.1056321215E+00  0.2405324425E+00
  0.2314710641E+00  0.9116063394E-01 -0.9685612450E+00
 -0.1242382691E+00  0.9902179526E+00  0.6350794261E-01
 Determinant of Hessian:  0.3351131512E+00
 Ellipticity of electron density:    0.009522
 eta index:    1.468414
 
 ----------------   CP   111,     Type (3,-1)   ----------------
 Connected atoms:    90(H )   --    45(H )
 Position (Bohr):        2.869756043276   -8.755167542199    0.000025126854
 Position (Angstrom):    1.518609498953   -4.633035140969    0.000013296558
 Density of all electrons:  0.4186136077E-02
 Density of Alpha electrons:  0.2093068038E-02
 Density of Beta electrons:  0.2093068038E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2761773396E-02
 G(r) in X,Y,Z:  0.2658280608E-02  0.5507858684E-04  0.4841420153E-04
 Hamiltonian kinetic energy K(r): -0.6268502285E-03
 Potential energy density V(r): -0.2134923168E-02
 Energy density E(r) or H(r):  0.6268502285E-03
 Laplacian of electron density:  0.1355449450E-01
 Electron localization function (ELF):  0.1252731398E-01
 Localized orbital locator (LOL):  0.1015605258E+00
 Local information entropy:  0.1031719012E-03
 Reduced density gradient (RDG):  0.1402762170E-14
 Reduced density gradient with promolecular approximation:  0.1956206859E-01
 Sign(lambda2)*rho: -0.4186136077E-02
 Sign(lambda2)*rho with promolecular approximation: -0.9856428141E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.7534850255E-08
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1170709488E-03
 Wavefunction value for orbital         1 :  0.5851763873E-07
 Average local ionization energy (ALIE):  0.5154846616E+00
 Delta-g (under promolecular approximation):  0.1543192355E-01
 Delta-g (under Hirshfeld partition):  0.8045464087E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4406631913E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5999025236E-17 -0.1252362304E-18  0.5708714619E-19
 Norm of gradient is:  0.6000603872E-17
 
 Components of Laplacian in x/y/z are:
  0.2049865400E-01 -0.3457528362E-02 -0.3486631142E-02
 Total:  0.1355449450E-01
 
 Hessian matrix:
  0.2049865400E-01 -0.7429201338E-03  0.1242127526E-02
 -0.7429201338E-03 -0.3457528362E-02 -0.7847319484E-04
  0.1242127526E-02 -0.7847319484E-04 -0.3486631142E-02
 Eigenvalues of Hessian: -0.3568939502E-02 -0.3462519528E-02  0.2058595353E-01
 Eigenvectors(columns) of Hessian:
 -0.3423065593E-01  0.4953004528E-01  0.9981858729E+00
  0.4128233467E+00  0.9102830204E+00 -0.3101140391E-01
  0.9101676475E+00 -0.4110128920E+00  0.5160674393E-01
 Determinant of Hessian:  0.2543913885E-06
 Ellipticity of electron density:    0.030735
 eta index:    0.173368
 
 ----------------   CP   112,     Type (3,-1)   ----------------
 Connected atoms:    90(H )   --    75(C )
 Position (Bohr):        0.002653690060   -8.486147637861   -0.275820907383
 Position (Angstrom):    0.001404272305   -4.490675938314   -0.145958138477
 Density of all electrons:  0.2828521924E+00
 Density of Alpha electrons:  0.1414260962E+00
 Density of Beta electrons:  0.1414260962E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3683629474E-01
 G(r) in X,Y,Z:  0.7942405735E-02  0.1162315061E-01  0.1727073839E-01
 Hamiltonian kinetic energy K(r):  0.2840662718E+00
 Potential energy density V(r): -0.3209025666E+00
 Energy density E(r) or H(r): -0.2840662718E+00
 Laplacian of electron density: -0.9889199084E+00
 Electron localization function (ELF):  0.9890352915E+00
 Localized orbital locator (LOL):  0.9047622273E+00
 Local information entropy:  0.4446418362E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2828521924E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1787095381E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3520819964E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9268541008E-02
 Wavefunction value for orbital         1 : -0.1530150474E-06
 Average local ionization energy (ALIE):  0.5621004736E+00
 Delta-g (under promolecular approximation):  0.3020363215E+00
 Delta-g (under Hirshfeld partition):  0.5284343757E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5029923088E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4627527338E-15  0.4524104615E-15  0.1584917229E-15
 Norm of gradient is:  0.6662844322E-15
 
 Components of Laplacian in x/y/z are:
  0.1746538374E+00 -0.5222219380E+00 -0.6413518079E+00
 Total: -0.9889199084E+00
 
 Hessian matrix:
  0.1746538374E+00 -0.4834104204E+00  0.3145722721E+00
 -0.4834104204E+00 -0.5222219380E+00 -0.1667931304E+00
  0.3145722721E+00 -0.1667931304E+00 -0.6413518079E+00
 Eigenvalues of Hessian: -0.7708154648E+00 -0.7484007952E+00  0.5302963515E+00
 Eigenvectors(columns) of Hessian:
  0.3868235038E+00 -0.3547864619E+00  0.8511722172E+00
  0.8966671594E+00 -0.7079521813E-01 -0.4370080575E+00
  0.2153034653E+00  0.9322631622E+00  0.2907401147E+00
 Determinant of Hessian:  0.3059167795E+00
 Ellipticity of electron density:    0.029950
 eta index:    1.453556
 
 ----------------   CP   113,     Type (3,-1)   ----------------
 Connected atoms:    20(C )   --    21(C )
 Position (Bohr):       -8.371661861173   -6.113417783687    4.284767767796
 Position (Angstrom):   -4.430092674319   -3.235081371856    2.267401456729
 Density of all electrons:  0.3173498948E+00
 Density of Alpha electrons:  0.1586749474E+00
 Density of Beta electrons:  0.1586749474E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1056366841E+00
 G(r) in X,Y,Z:  0.3505073860E-01  0.2690058552E-01  0.4368536002E-01
 Hamiltonian kinetic energy K(r):  0.3393496234E+00
 Potential energy density V(r): -0.4449863076E+00
 Energy density E(r) or H(r): -0.3393496234E+00
 Laplacian of electron density: -0.9348517571E+00
 Electron localization function (ELF):  0.9415281698E+00
 Localized orbital locator (LOL):  0.8005242646E+00
 Local information entropy:  0.4911345518E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3173498948E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2204228703E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4658208543E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6632263650E-02
 Wavefunction value for orbital         1 : -0.5817194838E-06
 Average local ionization energy (ALIE):  0.6427634198E+00
 Delta-g (under promolecular approximation):  0.3923729672E+00
 Delta-g (under Hirshfeld partition):  0.5709227981E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4935055182E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3656145719E-15 -0.1145307659E-15 -0.2314589526E-15
 Norm of gradient is:  0.4476209985E-15
 
 Components of Laplacian in x/y/z are:
 -0.5682714630E+00 -0.6769651552E-01 -0.2988837786E+00
 Total: -0.9348517571E+00
 
 Hessian matrix:
 -0.5682714630E+00  0.2546098481E+00 -0.1784065780E+00
  0.2546098481E+00 -0.6769651552E-01 -0.3816234720E+00
 -0.1784065780E+00 -0.3816234720E+00 -0.2988837786E+00
 Eigenvalues of Hessian: -0.6772157924E+00 -0.5813776606E+00  0.3237416958E+00
 Eigenvectors(columns) of Hessian:
  0.9411112214E+00  0.7777334825E-01 -0.3290303562E+00
 -0.3128345087E+00  0.5694238399E+00 -0.7601914632E+00
  0.1282350935E+00  0.8183567663E+00  0.5602213526E+00
 Determinant of Hessian:  0.1274629761E+00
 Ellipticity of electron density:    0.164847
 eta index:    2.091840
 
 ----------------   CP   114,     Type (3,-1)   ----------------
 Connected atoms:    88(H )   --    69(N )
 Position (Bohr):        0.851468122149   -7.094672043781    3.781313859817
 Position (Angstrom):    0.450577526052   -3.754338764399    2.000985121887
 Density of all electrons:  0.3367117074E+00
 Density of Alpha electrons:  0.1683558537E+00
 Density of Beta electrons:  0.1683558537E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4700567615E-01
 G(r) in X,Y,Z:  0.2540642217E-01  0.6225993736E-02  0.1537326025E-01
 Hamiltonian kinetic energy K(r):  0.5251560604E+00
 Potential energy density V(r): -0.5721617366E+00
 Energy density E(r) or H(r): -0.5251560604E+00
 Laplacian of electron density: -0.1912601537E+01
 Electron localization function (ELF):  0.9900048011E+00
 Localized orbital locator (LOL):  0.9087125236E+00
 Local information entropy:  0.5168743834E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3367117074E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2142223889E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4568343971E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1882635498E-01
 Wavefunction value for orbital         1 :  0.3833290507E-06
 Average local ionization energy (ALIE):  0.7058613638E+00
 Delta-g (under promolecular approximation):  0.4962289018E+00
 Delta-g (under Hirshfeld partition):  0.7429815301E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5040072533E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4535946136E-16  0.5620783583E-16  0.7429865964E-16
 Norm of gradient is:  0.1036199419E-15
 
 Components of Laplacian in x/y/z are:
 -0.1250344278E+01  0.6557792911E+00 -0.1318036550E+01
 Total: -0.1912601537E+01
 
 Hessian matrix:
 -0.1250344278E+01 -0.3949266185E+00 -0.7372082100E-01
 -0.3949266185E+00  0.6557792911E+00  0.3079209125E+00
 -0.7372082100E-01  0.3079209125E+00 -0.1318036550E+01
 Eigenvalues of Hessian: -0.1369312034E+01 -0.1325320370E+01  0.7820308662E+00
 Eigenvectors(columns) of Hessian:
  0.3087574171E+00  0.9311822767E+00  0.1938257592E+00
 -0.8384777074E-01  0.2296363767E+00 -0.9696580252E+00
  0.9474378126E+00 -0.2831372495E+00 -0.1489794926E+00
 Determinant of Hessian:  0.1419211731E+01
 Ellipticity of electron density:    0.033193
 eta index:    1.750969
 
 ----------------   CP   115,     Type (3,-1)   ----------------
 Connected atoms:    92(H )   --    50(H )
 Position (Bohr):       -5.690569933701   -6.883067058143    1.617779213067
 Position (Angstrom):   -3.011319925964   -3.642362228286    0.856091891828
 Density of all electrons:  0.4957394660E-02
 Density of Alpha electrons:  0.2478697330E-02
 Density of Beta electrons:  0.2478697330E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3349916019E-02
 G(r) in X,Y,Z:  0.7038408211E-03  0.1429382470E-02  0.1216692728E-02
 Hamiltonian kinetic energy K(r): -0.8352984253E-03
 Potential energy density V(r): -0.2514617594E-02
 Energy density E(r) or H(r):  0.8352984253E-03
 Laplacian of electron density:  0.1674085778E-01
 Electron localization function (ELF):  0.1494352689E-01
 Localized orbital locator (LOL):  0.1099521776E+00
 Local information entropy:  0.1204043395E-03
 Reduced density gradient (RDG):  0.1780408935E-14
 Reduced density gradient with promolecular approximation:  0.5504089967E-01
 Sign(lambda2)*rho: -0.4957394660E-02
 Sign(lambda2)*rho with promolecular approximation: -0.9661996650E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5329833304E-07
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1467798426E-03
 Wavefunction value for orbital         1 : -0.1436099518E-05
 Average local ionization energy (ALIE):  0.5078298979E+00
 Delta-g (under promolecular approximation):  0.1402084038E-01
 Delta-g (under Hirshfeld partition):  0.9625848659E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4784208008E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4292685222E-17  0.5016054667E-17  0.6353640459E-17
 Norm of gradient is:  0.9162788764E-17
 
 Components of Laplacian in x/y/z are:
  0.2144627387E-02  0.8377482282E-02  0.6218748109E-02
 Total:  0.1674085778E-01
 
 Hessian matrix:
  0.2144627387E-02 -0.6817778138E-02 -0.5575707922E-02
 -0.6817778138E-02  0.8377482282E-02  0.9896607275E-02
 -0.5575707922E-02  0.9896607275E-02  0.6218748109E-02
 Eigenvalues of Hessian: -0.2804823605E-02 -0.1750993404E-02  0.2129667479E-01
 Eigenvectors(columns) of Hessian:
  0.3414670368E+00  0.8420477152E+00 -0.4175594665E+00
  0.7310278057E+00  0.4129987060E-01  0.6810966656E+00
 -0.5907610431E+00  0.5378196407E+00  0.6014577492E+00
 Determinant of Hessian:  0.1045928177E-06
 Ellipticity of electron density:    0.601847
 eta index:    0.131702
 
 ----------------   CP   116,     Type (3,-1)   ----------------
 Connected atoms:    45(H )   --    12(C )
 Position (Bohr):        5.642099070548   -8.603181431112    0.086637342888
 Position (Angstrom):    2.985670249791   -4.552607554608    0.045846507470
 Density of all electrons:  0.2874710607E+00
 Density of Alpha electrons:  0.1437355304E+00
 Density of Beta electrons:  0.1437355304E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3474351682E-01
 G(r) in X,Y,Z:  0.8935761300E-02  0.9988566303E-02  0.1581918922E-01
 Hamiltonian kinetic energy K(r):  0.2937125136E+00
 Potential energy density V(r): -0.3284560304E+00
 Energy density E(r) or H(r): -0.2937125136E+00
 Laplacian of electron density: -0.1035875987E+01
 Electron localization function (ELF):  0.9907422119E+00
 Localized orbital locator (LOL):  0.9118778713E+00
 Local information entropy:  0.4509161471E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2874710607E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1806251452E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3343966113E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8012003852E-02
 Wavefunction value for orbital         1 : -0.4339582522E-06
 Average local ionization energy (ALIE):  0.5693950037E+00
 Delta-g (under promolecular approximation):  0.3113138334E+00
 Delta-g (under Hirshfeld partition):  0.5397782086E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4649031443E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1925454120E-15 -0.2249719508E-16 -0.5510457542E-16
 Norm of gradient is:  0.2015350433E-15
 
 Components of Laplacian in x/y/z are:
 -0.8249640426E-01 -0.1889815588E+00 -0.7643980241E+00
 Total: -0.1035875987E+01
 
 Hessian matrix:
 -0.8249640426E-01  0.6531126116E+00 -0.1195627300E+00
  0.6531126116E+00 -0.1889815588E+00 -0.1104558778E+00
 -0.1195627300E+00 -0.1104558778E+00 -0.7643980241E+00
 Eigenvalues of Hessian: -0.7910232000E+00 -0.7847078822E+00  0.5398550951E+00
 Eigenvectors(columns) of Hessian:
 -0.6749534884E+00  0.1100906545E+00  0.7296011488E+00
  0.7373318774E+00  0.6321793606E-01  0.6725661269E+00
  0.2791936634E-01  0.9919090383E+00 -0.1238425155E+00
 Determinant of Hessian:  0.3351000099E+00
 Ellipticity of electron density:    0.008048
 eta index:    1.465251
 
 ----------------   CP   117,     Type (3,-1)   ----------------
 Connected atoms:    92(H )   --    64(Cl)
 Position (Bohr):       -5.616250494889   -7.959099585952   -2.555588470954
 Position (Angstrom):   -2.971991772618   -4.211774120193   -1.352359179276
 Density of all electrons:  0.4637045574E-02
 Density of Alpha electrons:  0.2318522787E-02
 Density of Beta electrons:  0.2318522787E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2989757045E-02
 G(r) in X,Y,Z:  0.3754361186E-03  0.2937780595E-03  0.2320542867E-02
 Hamiltonian kinetic energy K(r): -0.7824500477E-03
 Potential energy density V(r): -0.2207306997E-02
 Energy density E(r) or H(r):  0.7824500477E-03
 Laplacian of electron density:  0.1508882837E-01
 Electron localization function (ELF):  0.1500389693E-01
 Localized orbital locator (LOL):  0.1101877566E+00
 Local information entropy:  0.1132800450E-03
 Reduced density gradient (RDG):  0.7820521009E-15
 Reduced density gradient with promolecular approximation:  0.2559918628E+00
 Sign(lambda2)*rho: -0.4637045574E-02
 Sign(lambda2)*rho with promolecular approximation: -0.7904128754E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3902329255E-09
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1192292013E-03
 Wavefunction value for orbital         1 :  0.7884245100E-05
 Average local ionization energy (ALIE):  0.4847269712E+00
 Delta-g (under promolecular approximation):  0.1016668913E-01
 Delta-g (under Hirshfeld partition):  0.8876889542E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4634887124E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1871095780E-17  0.5983228981E-18 -0.3717362908E-17
 Norm of gradient is:  0.4204494821E-17
 
 Components of Laplacian in x/y/z are:
 -0.7044944698E-03 -0.1465057136E-02  0.1725837998E-01
 Total:  0.1508882837E-01
 
 Hessian matrix:
 -0.7044944698E-03 -0.1693036498E-02  0.6545428925E-02
 -0.1693036498E-02 -0.1465057136E-02 -0.4471442939E-02
  0.6545428925E-02 -0.4471442939E-02  0.1725837998E-01
 Eigenvalues of Hessian: -0.2946450882E-02 -0.2396886018E-02  0.2043216527E-01
 Eigenvectors(columns) of Hessian:
  0.8794676481E+00 -0.3657646712E+00  0.3045535441E+00
  0.4371894620E+00  0.8737542575E+00 -0.2131170380E+00
 -0.1881542724E+00  0.3205771403E+00  0.9283470617E+00
 Determinant of Hessian:  0.1442982222E-06
 Ellipticity of electron density:    0.229283
 eta index:    0.144206
 
 ----------------   CP   118,     Type (3,+1)   ----------------
 Position (Bohr):      -10.506150540447   -5.371677759927    3.995281853663
 Position (Angstrom):   -5.559615440321   -2.842569454868    2.114212108093
 Density of all electrons:  0.2407773431E-01
 Density of Alpha electrons:  0.1203886716E-01
 Density of Beta electrons:  0.1203886716E-01
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3365194951E-01
 G(r) in X,Y,Z:  0.1515386815E-01  0.1116748328E-01  0.7330598077E-02
 Hamiltonian kinetic energy K(r): -0.4680115293E-02
 Potential energy density V(r): -0.2897183422E-01
 Energy density E(r) or H(r):  0.4680115293E-02
 Laplacian of electron density:  0.1533282592E+00
 Electron localization function (ELF):  0.2848992778E-01
 Localized orbital locator (LOL):  0.1462459457E+00
 Local information entropy:  0.5041758574E-03
 Reduced density gradient (RDG):  0.4187114741E-15
 Reduced density gradient with promolecular approximation:  0.9669232124E-02
 Sign(lambda2)*rho:  0.2407773431E-01
 Sign(lambda2)*rho with promolecular approximation:  0.5823665855E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2163044668E-07
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.9794257593E-03
 Wavefunction value for orbital         1 :  0.1383977856E-05
 Average local ionization energy (ALIE):  0.7801075197E+00
 Delta-g (under promolecular approximation):  0.9175977312E-01
 Delta-g (under Hirshfeld partition):  0.4893672058E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4573149371E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1765638855E-16  0.1235450493E-17 -0.5054538418E-17
 Norm of gradient is:  0.1840713865E-16
 
 Components of Laplacian in x/y/z are:
  0.8542382579E-01  0.5079586346E-01  0.1710856995E-01
 Total:  0.1533282592E+00
 
 Hessian matrix:
  0.8542382579E-01 -0.5943250049E-02 -0.6824409908E-02
 -0.5943250049E-02  0.5079586346E-01 -0.4623514414E-01
 -0.6824409908E-02 -0.4623514414E-01  0.1710856995E-01
 Eigenvalues of Hessian: -0.1605357737E-01  0.8288828312E-01  0.8649355346E-01
 Eigenvectors(columns) of Hessian:
  0.8834107482E-01  0.2733745212E+00 -0.9578424848E+00
  0.5719104320E+00  0.7733879211E+00  0.2734768389E+00
  0.8155454079E+00 -0.5719593471E+00 -0.8802382030E-01
 Determinant of Hessian: -0.1150929467E-03
 Ellipticity of electron density:   -1.193677
 eta index:    0.185604
 
 ----------------   CP   119,     Type (3,-1)   ----------------
 Connected atoms:    75(C )   --    91(H )
 Position (Bohr):       -1.123150506051   -7.953428447216   -2.017149813723
 Position (Angstrom):   -0.594345652216   -4.208773082814   -1.067429712400
 Density of all electrons:  0.2852393463E+00
 Density of Alpha electrons:  0.1426196731E+00
 Density of Beta electrons:  0.1426196731E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3620099390E-01
 G(r) in X,Y,Z:  0.1883264654E-01  0.1369107885E-01  0.3677268506E-02
 Hamiltonian kinetic energy K(r):  0.2877948656E+00
 Potential energy density V(r): -0.3239958595E+00
 Energy density E(r) or H(r): -0.2877948656E+00
 Laplacian of electron density: -0.1006375487E+01
 Electron localization function (ELF):  0.9896958066E+00
 Localized orbital locator (LOL):  0.9074340511E+00
 Local information entropy:  0.4478865457E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2852393463E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1794277040E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1225577531E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9670035418E-02
 Wavefunction value for orbital         1 : -0.2223481965E-05
 Average local ionization energy (ALIE):  0.5612814334E+00
 Delta-g (under promolecular approximation):  0.3058007942E+00
 Delta-g (under Hirshfeld partition):  0.5343273164E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5079022909E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2309096518E-16  0.8494956955E-16 -0.1063195755E-15
 Norm of gradient is:  0.1380343225E-15
 
 Components of Laplacian in x/y/z are:
 -0.7631508869E+00 -0.7796856003E+00  0.5364610005E+00
 Total: -0.1006375487E+01
 
 Hessian matrix:
 -0.7631508869E+00 -0.3652848464E-02 -0.1595706863E-01
 -0.3652848464E-02 -0.7796856003E+00  0.5255765320E-01
 -0.1595706863E-01  0.5255765320E-01  0.5364610005E+00
 Eigenvalues of Hessian: -0.7822614050E+00 -0.7628693819E+00  0.5387553002E+00
 Eigenvectors(columns) of Hessian:
 -0.1573757848E+00 -0.9874614653E+00 -0.1235786373E-01
 -0.9868293547E+00  0.1567761661E+00  0.3986299486E-01
  0.3742575282E-01 -0.1846857279E-01  0.9991287329E+00
 Determinant of Hessian:  0.3215093771E+00
 Ellipticity of electron density:    0.025420
 eta index:    1.451979
 
 ----------------   CP   120,     Type (3,+1)   ----------------
 Position (Bohr):       -3.865687061122   -7.769570296085   -3.304175855500
 Position (Angstrom):   -2.045633497228   -4.111479539197   -1.748494563547
 Density of all electrons:  0.2750159171E-02
 Density of Alpha electrons:  0.1375079585E-02
 Density of Beta electrons:  0.1375079585E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1941111386E-02
 G(r) in X,Y,Z:  0.1058859502E-02  0.1320871922E-03  0.7501646921E-03
 Hamiltonian kinetic energy K(r): -0.6430487504E-03
 Potential energy density V(r): -0.1298062636E-02
 Energy density E(r) or H(r):  0.6430487504E-03
 Laplacian of electron density:  0.1033664055E-01
 Electron localization function (ELF):  0.6271434980E-02
 Localized orbital locator (LOL):  0.7394644257E-01
 Local information entropy:  0.7022855096E-04
 Reduced density gradient (RDG):  0.1386526480E-14
 Reduced density gradient with promolecular approximation:  0.4273120723E+00
 Sign(lambda2)*rho:  0.2750159171E-02
 Sign(lambda2)*rho with promolecular approximation:  0.5869104457E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.9892367472E-07
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.8858232254E-04
 Wavefunction value for orbital         1 :  0.6344496921E-05
 Average local ionization energy (ALIE):  0.5143782506E+00
 Delta-g (under promolecular approximation):  0.6505597758E-02
 Delta-g (under Hirshfeld partition):  0.5135576914E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4677917109E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5605637575E-18 -0.6448451901E-18  0.2838615856E-17
 Norm of gradient is:  0.2964421870E-17
 
 Components of Laplacian in x/y/z are:
  0.6995474813E-02 -0.1166112062E-02  0.4507277796E-02
 Total:  0.1033664055E-01
 
 Hessian matrix:
  0.6995474813E-02 -0.8813947113E-03  0.4771316330E-02
 -0.8813947113E-03 -0.1166112062E-02 -0.1281574376E-02
  0.4771316330E-02 -0.1281574376E-02  0.4507277796E-02
 Eigenvalues of Hessian: -0.1446565666E-02  0.9183240143E-03  0.1086488220E-01
 Eigenvectors(columns) of Hessian:
 -0.3064579017E-01 -0.6227818806E+00  0.7817950913E+00
  0.9718151370E+00 -0.2014767104E+00 -0.1224029198E+00
  0.2337438237E+00  0.7560091695E+00  0.6114032716E+00
 Determinant of Hessian: -0.1443308324E-07
 Ellipticity of electron density:   -2.575224
 eta index:    0.133141
 
 ----------------   CP   121,     Type (3,+1)   ----------------
 Position (Bohr):       -5.887531591969   -7.089423632532   -2.172305610445
 Position (Angstrom):   -3.115547546942   -3.751561424773   -1.149534624164
 Density of all electrons:  0.4154753754E-02
 Density of Alpha electrons:  0.2077376877E-02
 Density of Beta electrons:  0.2077376877E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2912339231E-02
 G(r) in X,Y,Z:  0.4303521544E-03  0.1011045737E-02  0.1470941339E-02
 Hamiltonian kinetic energy K(r): -0.7625627780E-03
 Potential energy density V(r): -0.2149776452E-02
 Energy density E(r) or H(r):  0.7625627780E-03
 Laplacian of electron density:  0.1469960803E-01
 Electron localization function (ELF):  0.1100744619E-01
 Localized orbital locator (LOL):  0.9572711112E-01
 Local information entropy:  0.1024646876E-03
 Reduced density gradient (RDG):  0.1587862302E-14
 Reduced density gradient with promolecular approximation:  0.6634675807E-01
 Sign(lambda2)*rho:  0.4154753754E-02
 Sign(lambda2)*rho with promolecular approximation:  0.7800983199E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1753331431E-10
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1235493438E-03
 Wavefunction value for orbital         1 :  0.1963984237E-04
 Average local ionization energy (ALIE):  0.5017376945E+00
 Delta-g (under promolecular approximation):  0.1117216544E-01
 Delta-g (under Hirshfeld partition):  0.8230253227E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4811878124E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.8331627827E-18  0.2263695552E-17 -0.5886151064E-17
 Norm of gradient is:  0.6361230394E-17
 
 Components of Laplacian in x/y/z are:
  0.1343009247E-03  0.5147414996E-02  0.9417892114E-02
 Total:  0.1469960803E-01
 
 Hessian matrix:
  0.1343009247E-03 -0.3937674899E-02  0.3730239184E-02
 -0.3937674899E-02  0.5147414996E-02 -0.4166988393E-02
  0.3730239184E-02 -0.4166988393E-02  0.9417892114E-02
 Eigenvalues of Hessian: -0.2214853098E-02  0.2942565648E-02  0.1397189548E-01
 Eigenvectors(columns) of Hessian:
  0.9043769099E+00 -0.2329456193E+00  0.3575454423E+00
  0.4008276375E+00  0.7512003326E+00 -0.5244380472E+00
 -0.1464227095E+00  0.6176037555E+00  0.7727392777E+00
 Determinant of Hessian: -0.9105974199E-07
 Ellipticity of electron density:   -1.752695
 eta index:    0.158522
 
 ----------------   CP   122,     Type (3,-1)   ----------------
 Connected atoms:    24(C )   --    23(C )
 Position (Bohr):      -12.654647461411   -4.661298210158    3.741089567337
 Position (Angstrom):   -6.696551048590   -2.466652786039    1.979699342981
 Density of all electrons:  0.3161405851E+00
 Density of Alpha electrons:  0.1580702926E+00
 Density of Beta electrons:  0.1580702926E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1046490432E+00
 G(r) in X,Y,Z:  0.3487694446E-01  0.2678295529E-01  0.4298914350E-01
 Hamiltonian kinetic energy K(r):  0.3368690224E+00
 Potential energy density V(r): -0.4415180656E+00
 Energy density E(r) or H(r): -0.3368690224E+00
 Laplacian of electron density: -0.9288799165E+00
 Electron localization function (ELF):  0.9418608203E+00
 Localized orbital locator (LOL):  0.8010076981E+00
 Local information entropy:  0.4895187304E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3161405851E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2196655217E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4193738222E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5281689826E-02
 Wavefunction value for orbital         1 :  0.1904938147E-06
 Average local ionization energy (ALIE):  0.6419826409E+00
 Delta-g (under promolecular approximation):  0.3914530155E+00
 Delta-g (under Hirshfeld partition):  0.5692357830E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4467924194E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1621182018E-15 -0.6147574549E-16 -0.1937549750E-15
 Norm of gradient is:  0.2600049403E-15
 
 Components of Laplacian in x/y/z are:
 -0.5672141760E+00 -0.7215618790E-01 -0.2895095526E+00
 Total: -0.9288799165E+00
 
 Hessian matrix:
 -0.5672141760E+00  0.2504972408E+00 -0.1779803121E+00
  0.2504972408E+00 -0.7215618790E-01 -0.3840717938E+00
 -0.1779803121E+00 -0.3840717938E+00 -0.2895095526E+00
 Eigenvalues of Hessian: -0.6738506868E+00 -0.5791967596E+00  0.3241675299E+00
 Eigenvectors(columns) of Hessian:
  0.9415434804E+00  0.8569799447E-01 -0.3258093434E+00
 -0.3138955136E+00  0.5743390671E+00 -0.7560451326E+00
  0.1223334827E+00  0.8141194567E+00  0.5676654202E+00
 Determinant of Hessian:  0.1265200371E+00
 Ellipticity of electron density:    0.163423
 eta index:    2.078711
 
 ----------------   CP   123,     Type (3,-1)   ----------------
 Connected atoms:    13(C )   --    12(C )
 Position (Bohr):        7.867361911827   -8.093586742711   -0.148117476981
 Position (Angstrom):    4.163228633665   -4.282941658709   -0.078380393355
 Density of all electrons:  0.3180359125E+00
 Density of Alpha electrons:  0.1590179563E+00
 Density of Beta electrons:  0.1590179563E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1042222892E+00
 G(r) in X,Y,Z:  0.8233300263E-02  0.3594761884E-01  0.6004137005E-01
 Hamiltonian kinetic energy K(r):  0.3400437175E+00
 Potential energy density V(r): -0.4442660066E+00
 Energy density E(r) or H(r): -0.3400437175E+00
 Laplacian of electron density: -0.9432857133E+00
 Electron localization function (ELF):  0.9433803733E+00
 Localized orbital locator (LOL):  0.8032374787E+00
 Local information entropy:  0.4920507414E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3180359125E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2200246972E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1605646708E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6649801496E-02
 Wavefunction value for orbital         1 :  0.1855802490E-06
 Average local ionization energy (ALIE):  0.6464334931E+00
 Delta-g (under promolecular approximation):  0.3944796471E+00
 Delta-g (under Hirshfeld partition):  0.5725440932E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4818846959E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.6120236560E-16  0.1894321424E-15  0.2908372328E-16
 Norm of gradient is:  0.2011868015E-15
 
 Components of Laplacian in x/y/z are:
  0.2391013821E+00 -0.5953098574E+00 -0.5870772380E+00
 Total: -0.9432857133E+00
 
 Hessian matrix:
  0.2391013821E+00 -0.2786634587E+00 -0.4428842165E-01
 -0.2786634587E+00 -0.5953098574E+00  0.2379243109E-01
 -0.4428842165E-01  0.2379243109E-01 -0.5870772380E+00
 Eigenvalues of Hessian: -0.6808909946E+00 -0.5886613877E+00  0.3262666691E+00
 Eigenvectors(columns) of Hessian:
 -0.2834401772E+00  0.8266338154E-01 -0.9554205521E+00
 -0.9529049067E+00  0.8777742803E-01  0.2902884117E+00
  0.1078605805E+00  0.9927043308E+00  0.5389069212E-01
 Determinant of Hessian:  0.1307723263E+00
 Ellipticity of electron density:    0.156677
 eta index:    2.086916
 
 ----------------   CP   124,     Type (3,-1)   ----------------
 Connected atoms:    91(H )   --    64(Cl)
 Position (Bohr):       -3.606197386581   -7.688642401143   -3.654688532060
 Position (Angstrom):   -1.908317474996   -4.068654341467   -1.933977884115
 Density of all electrons:  0.2777508691E-02
 Density of Alpha electrons:  0.1388754346E-02
 Density of Beta electrons:  0.1388754346E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1844558148E-02
 G(r) in X,Y,Z:  0.1146149425E-02  0.1030245887E-03  0.5953841349E-03
 Hamiltonian kinetic energy K(r): -0.5968376428E-03
 Potential energy density V(r): -0.1247720506E-02
 Energy density E(r) or H(r):  0.5968376428E-03
 Laplacian of electron density:  0.9765583164E-02
 Electron localization function (ELF):  0.7167761713E-02
 Localized orbital locator (LOL):  0.7870472275E-01
 Local information entropy:  0.7086872208E-04
 Reduced density gradient (RDG):  0.3814788014E-14
 Reduced density gradient with promolecular approximation:  0.4106767365E+00
 Sign(lambda2)*rho: -0.2777508691E-02
 Sign(lambda2)*rho with promolecular approximation: -0.5501249067E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1245176732E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.8405520731E-04
 Wavefunction value for orbital         1 :  0.6067769575E-05
 Average local ionization energy (ALIE):  0.5002024836E+00
 Delta-g (under promolecular approximation):  0.6247635980E-02
 Delta-g (under Hirshfeld partition):  0.5159047386E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4645312919E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4411109361E-17 -0.2244372612E-17  0.8079046573E-17
 Norm of gradient is:  0.9474496702E-17
 
 Components of Laplacian in x/y/z are:
  0.7991557673E-02 -0.1409722226E-02  0.3183747717E-02
 Total:  0.9765583164E-02
 
 Hessian matrix:
  0.7991557673E-02 -0.1146876066E-02  0.5867608982E-02
 -0.1146876066E-02 -0.1409722226E-02 -0.9072372353E-03
  0.5867608982E-02 -0.9072372353E-03  0.3183747717E-02
 Eigenvalues of Hessian: -0.1582785507E-02 -0.7377222914E-03  0.1208609096E-01
 Eigenvectors(columns) of Hessian:
  0.1259528271E-01 -0.5649091120E+00  0.8250570004E+00
  0.9850201245E+00 -0.1349051223E+00 -0.1074055971E+00
  0.1719788161E+00  0.8140505532E+00  0.5547476757E+00
 Determinant of Hessian:  0.1411239845E-07
 Ellipticity of electron density:    1.145503
 eta index:    0.130959
 
 ----------------   CP   125,     Type (3,-1)   ----------------
 Connected atoms:    92(H )   --    62(N )
 Position (Bohr):       -6.120099516070   -6.556183858718   -1.097925055861
 Position (Angstrom):   -3.238617192363   -3.469383088523   -0.580996918841
 Density of all electrons:  0.5054838441E-02
 Density of Alpha electrons:  0.2527419220E-02
 Density of Beta electrons:  0.2527419220E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3106231674E-02
 G(r) in X,Y,Z:  0.8124875162E-03  0.1774560825E-02  0.5191833328E-03
 Hamiltonian kinetic energy K(r): -0.6830666568E-03
 Potential energy density V(r): -0.2423165017E-02
 Energy density E(r) or H(r):  0.6830666568E-03
 Laplacian of electron density:  0.1515719332E-01
 Electron localization function (ELF):  0.1847022189E-01
 Localized orbital locator (LOL):  0.1209715246E+00
 Local information entropy:  0.1225625726E-03
 Reduced density gradient (RDG):  0.1631125353E-14
 Reduced density gradient with promolecular approximation:  0.3913106795E+00
 Sign(lambda2)*rho: -0.5054838441E-02
 Sign(lambda2)*rho with promolecular approximation: -0.7971824868E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1396375601E-08
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1334889084E-03
 Wavefunction value for orbital         1 :  0.5350562103E-06
 Average local ionization energy (ALIE):  0.4673804340E+00
 Delta-g (under promolecular approximation):  0.9118370196E-02
 Delta-g (under Hirshfeld partition):  0.9171884355E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4896384983E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4432099897E-17  0.7045620055E-17 -0.2641895762E-17
 Norm of gradient is:  0.8732919596E-17
 
 Components of Laplacian in x/y/z are:
  0.2946992594E-02  0.1190901200E-01  0.3011887303E-03
 Total:  0.1515719332E-01
 
 Hessian matrix:
  0.2946992594E-02 -0.9743915935E-02  0.4250741068E-02
 -0.9743915935E-02  0.1190901200E-01 -0.7012036687E-02
  0.4250741068E-02 -0.7012036687E-02  0.3011887303E-03
 Eigenvalues of Hessian: -0.3372458187E-02 -0.2816467466E-02  0.2134611898E-01
 Eigenvectors(columns) of Hessian:
  0.7121524638E+00 -0.4925856415E+00 -0.5001982148E+00
  0.6119501146E+00  0.8641166753E-01  0.7861616125E+00
  0.3440289604E+00  0.8659632841E+00 -0.3629761217E+00
 Determinant of Hessian:  0.2027543770E-06
 Ellipticity of electron density:    0.197407
 eta index:    0.157989
 
 ----------------   CP   126,     Type (3,-1)   ----------------
 Connected atoms:    75(C )   --    67(N )
 Position (Bohr):       -1.115448786067   -6.918527420148   -0.417726259762
 Position (Angstrom):   -0.590270077516   -3.661127043750   -0.221051217062
 Density of all electrons:  0.2513083705E+00
 Density of Alpha electrons:  0.1256541852E+00
 Density of Beta electrons:  0.1256541852E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1493254183E+00
 G(r) in X,Y,Z:  0.6283344186E-01  0.2734424362E-01  0.5914773281E-01
 Hamiltonian kinetic energy K(r):  0.3000368856E+00
 Potential energy density V(r): -0.4493623039E+00
 Energy density E(r) or H(r): -0.3000368856E+00
 Laplacian of electron density: -0.6028458692E+00
 Electron localization function (ELF):  0.7873495887E+00
 Localized orbital locator (LOL):  0.6580414438E+00
 Local information entropy:  0.4013508358E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2513083705E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2376831433E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2348351848E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6833452466E-02
 Wavefunction value for orbital         1 : -0.8630005741E-06
 Average local ionization energy (ALIE):  0.7774683103E+00
 Delta-g (under promolecular approximation):  0.2576480452E+00
 Delta-g (under Hirshfeld partition):  0.3486264543E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5621209425E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.7979897396E-16 -0.8438819847E-16  0.1189064851E-15
 Norm of gradient is:  0.1662167154E-15
 
 Components of Laplacian in x/y/z are:
 -0.4616464369E+00  0.2734631937E+00 -0.4146626260E+00
 Total: -0.6028458692E+00
 
 Hessian matrix:
 -0.4616464369E+00  0.1876798585E-01  0.3209991354E-02
  0.1876798585E-01  0.2734631937E+00  0.1908840189E+00
  0.3209991354E-02  0.1908840189E+00 -0.4146626260E+00
 Eigenvalues of Hessian: -0.4649575740E+00 -0.4612138302E+00  0.3233255350E+00
 Eigenvectors(columns) of Hessian:
  0.4877678769E+00  0.8726388683E+00 -0.2416410011E-01
 -0.2300844373E+00  0.1018073350E+00 -0.9678307798E+00
  0.8421066737E+00 -0.4776365480E+00 -0.2504389706E+00
 Determinant of Hessian:  0.6933550025E-01
 Ellipticity of electron density:    0.008117
 eta index:    1.438048
 
 ----------------   CP   127,     Type (3,+1)   ----------------
 Position (Bohr):       -4.251284959074   -5.914496371226    1.600667755615
 Position (Angstrom):   -2.249683117397   -3.129816693621    0.847036898499
 Density of all electrons:  0.3185288837E-02
 Density of Alpha electrons:  0.1592644419E-02
 Density of Beta electrons:  0.1592644419E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2168309529E-02
 G(r) in X,Y,Z:  0.9585329863E-03  0.6651401095E-03  0.5446364331E-03
 Hamiltonian kinetic energy K(r): -0.6239376673E-03
 Potential energy density V(r): -0.1544371862E-02
 Energy density E(r) or H(r):  0.6239376673E-03
 Laplacian of electron density:  0.1116898878E-01
 Electron localization function (ELF):  0.8193840896E-02
 Localized orbital locator (LOL):  0.8367190877E-01
 Local information entropy:  0.8034885217E-04
 Reduced density gradient (RDG):  0.1050385730E-14
 Reduced density gradient with promolecular approximation:  0.1617848245E+00
 Sign(lambda2)*rho:  0.3185288837E-02
 Sign(lambda2)*rho with promolecular approximation:  0.7094619878E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3137219386E-07
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1191793140E-03
 Wavefunction value for orbital         1 : -0.1944865391E-06
 Average local ionization energy (ALIE):  0.5094348832E+00
 Delta-g (under promolecular approximation):  0.9310306029E-02
 Delta-g (under Hirshfeld partition):  0.6170486373E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5065129243E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1496495460E-17 -0.1708888971E-17  0.1614484502E-17
 Norm of gradient is:  0.2786819044E-17
 
 Components of Laplacian in x/y/z are:
  0.6152144558E-02  0.2968415722E-02  0.2048428505E-02
 Total:  0.1116898878E-01
 
 Hessian matrix:
  0.6152144558E-02 -0.5228819273E-03 -0.4309055337E-02
 -0.5228819273E-03  0.2968415722E-02  0.2100976161E-02
 -0.4309055337E-02  0.2100976161E-02  0.2048428505E-02
 Eigenvalues of Hessian: -0.1237878209E-02  0.3131801552E-02  0.9275065442E-02
 Eigenvectors(columns) of Hessian:
  0.4525706681E+00  0.3972918067E+00 -0.7983351494E+00
 -0.3528029424E+00  0.9019928203E+00  0.2488755431E+00
  0.8189687871E+00  0.1690212189E+00  0.5483812117E+00
 Determinant of Hessian: -0.3595747072E-07
 Ellipticity of electron density:   -1.395261
 eta index:    0.133463
 
 ----------------   CP   128,     Type (3,+1)   ----------------
 Position (Bohr):        2.741849242362   -7.072402183015   -0.077725670014
 Position (Angstrom):    1.450924134790   -3.742554061592   -0.041130653273
 Density of all electrons:  0.2320775887E-02
 Density of Alpha electrons:  0.1160387943E-02
 Density of Beta electrons:  0.1160387943E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2010635304E-02
 G(r) in X,Y,Z:  0.1078232335E-02  0.8246655918E-03  0.1077373773E-03
 Hamiltonian kinetic energy K(r): -0.6953788075E-03
 Potential energy density V(r): -0.1315256497E-02
 Energy density E(r) or H(r):  0.6953788075E-03
 Laplacian of electron density:  0.1082405645E-01
 Electron localization function (ELF):  0.3330350027E-02
 Localized orbital locator (LOL):  0.5490350962E-01
 Local information entropy:  0.6009842246E-04
 Reduced density gradient (RDG):  0.8160406082E-15
 Reduced density gradient with promolecular approximation:  0.1512754621E+00
 Sign(lambda2)*rho:  0.2320775887E-02
 Sign(lambda2)*rho with promolecular approximation:  0.7053142268E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.9017935887E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1135495064E-03
 Wavefunction value for orbital         1 : -0.1562969133E-06
 Average local ionization energy (ALIE):  0.5715369388E+00
 Delta-g (under promolecular approximation):  0.9668673280E-02
 Delta-g (under Hirshfeld partition):  0.4485955517E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4810278148E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.9193219153E-18  0.1175893489E-17  0.1939176054E-18
 Norm of gradient is:  0.1505151926E-17
 
 Components of Laplacian in x/y/z are:
  0.7713258404E-02  0.4383370661E-02 -0.1272572617E-02
 Total:  0.1082405645E-01
 
 Hessian matrix:
  0.7713258404E-02  0.3482741966E-02  0.9332817101E-04
  0.3482741966E-02  0.4383370661E-02 -0.4323391537E-04
  0.9332817101E-04 -0.4323391537E-04 -0.1272572617E-02
 Eigenvalues of Hessian: -0.1275004646E-02  0.2190217140E-02  0.9908843954E-02
 Eigenvectors(columns) of Hessian:
 -0.1751738458E-01 -0.5329242434E+00 -0.8459816145E+00
  0.1842021248E-01  0.8457958284E+00 -0.5331886275E+00
  0.9996768663E+00 -0.2492323134E-01 -0.4999553003E-02
 Determinant of Hessian: -0.2767081367E-07
 Ellipticity of electron density:   -1.582136
 eta index:    0.128673
 
 ----------------   CP   129,     Type (3,-1)   ----------------
 Connected atoms:    21(C )   --    50(H )
 Position (Bohr):       -6.640939110747   -4.957154630245    3.305490707163
 Position (Angstrom):   -3.514233636402   -2.623213261248    1.749190353082
 Density of all electrons:  0.2870039982E+00
 Density of Alpha electrons:  0.1435019991E+00
 Density of Beta electrons:  0.1435019991E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3586295308E-01
 G(r) in X,Y,Z:  0.3671148501E-02  0.1611129119E-01  0.1608051339E-01
 Hamiltonian kinetic energy K(r):  0.2938079451E+00
 Potential energy density V(r): -0.3296708981E+00
 Energy density E(r) or H(r): -0.2938079451E+00
 Laplacian of electron density: -0.1031779968E+01
 Electron localization function (ELF):  0.9900891351E+00
 Localized orbital locator (LOL):  0.9090723443E+00
 Local information entropy:  0.4502824041E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2870039982E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1813195773E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3461639763E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9202715440E-02
 Wavefunction value for orbital         1 : -0.3161187001E-07
 Average local ionization energy (ALIE):  0.5687321432E+00
 Delta-g (under promolecular approximation):  0.3107242196E+00
 Delta-g (under Hirshfeld partition):  0.5376004425E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5153833276E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1205270974E-16  0.1806467167E-16  0.1636488830E-16
 Norm of gradient is:  0.2719208972E-16
 
 Components of Laplacian in x/y/z are:
  0.4793405950E+00 -0.7697052262E+00 -0.7414153367E+00
 Total: -0.1031779968E+01
 
 Hessian matrix:
  0.4793405950E+00  0.1449272553E+00 -0.2315168161E+00
  0.1449272553E+00 -0.7697052262E+00 -0.2296427396E-01
 -0.2315168161E+00 -0.2296427396E-01 -0.7414153367E+00
 Eigenvalues of Hessian: -0.7887045130E+00 -0.7813010192E+00  0.5382255643E+00
 Eigenvectors(columns) of Hessian:
  0.1943590219E+00 -0.8147670500E-01  0.9775408519E+00
 -0.8049132264E+00 -0.5828308087E+00  0.1114582714E+00
  0.5606596726E+00 -0.8084984817E+00 -0.1788601034E+00
 Determinant of Hessian:  0.3316630104E+00
 Ellipticity of electron density:    0.009476
 eta index:    1.465379
 
 ----------------   CP   130,     Type (3,-1)   ----------------
 Connected atoms:    69(N )   --    97(H )
 Position (Bohr):        0.778157705449   -5.167757404729    5.338295839905
 Position (Angstrom):    0.411783324212   -2.734659450058    2.824904503536
 Density of all electrons:  0.3375006317E+00
 Density of Alpha electrons:  0.1687503158E+00
 Density of Beta electrons:  0.1687503158E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4643304672E-01
 G(r) in X,Y,Z:  0.2547449168E-01  0.1421949862E-01  0.6739056425E-02
 Hamiltonian kinetic energy K(r):  0.5285291160E+00
 Potential energy density V(r): -0.5749621627E+00
 Energy density E(r) or H(r): -0.5285291160E+00
 Laplacian of electron density: -0.1928384277E+01
 Electron localization function (ELF):  0.9903195044E+00
 Localized orbital locator (LOL):  0.9100440256E+00
 Local information entropy:  0.5179180929E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3375006317E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2144600820E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1657476710E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2054153837E-01
 Wavefunction value for orbital         1 :  0.2154022055E-06
 Average local ionization energy (ALIE):  0.7053512080E+00
 Delta-g (under promolecular approximation):  0.4962092300E+00
 Delta-g (under Hirshfeld partition):  0.7446538154E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5074616923E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1032211290E-15  0.3826526396E-15 -0.1599765716E-15
 Norm of gradient is:  0.4273992835E-15
 
 Components of Laplacian in x/y/z are:
 -0.1296448153E+01 -0.1098050226E+01  0.4661141026E+00
 Total: -0.1928384277E+01
 
 Hessian matrix:
 -0.1296448153E+01  0.1194405081E+00  0.2670119586E+00
  0.1194405081E+00 -0.1098050226E+01  0.7087484027E+00
  0.2670119586E+00  0.7087484027E+00  0.4661141026E+00
 Eigenvalues of Hessian: -0.1377239638E+01 -0.1331710730E+01  0.7805660904E+00
 Eigenvectors(columns) of Hessian:
  0.3541320310E+00 -0.9247666017E+00  0.1392739636E+00
 -0.8889356384E+00 -0.2866021199E+00  0.3572851181E+00
  0.2904891313E+00  0.2503316943E+00  0.9235529803E+00
 Determinant of Hessian:  0.1431624404E+01
 Ellipticity of electron density:    0.034188
 eta index:    1.764411
 
 ----------------   CP   131,     Type (3,-1)   ----------------
 Connected atoms:    13(C )   --    14(C )
 Position (Bohr):       10.058985320115   -7.578668962805   -0.364195360493
 Position (Angstrom):    5.322985796212   -4.010458904094   -0.192723885090
 Density of all electrons:  0.3167056218E+00
 Density of Alpha electrons:  0.1583528109E+00
 Density of Beta electrons:  0.1583528109E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1043122646E+00
 G(r) in X,Y,Z:  0.2148634418E-01  0.2309269201E-01  0.5973322839E-01
 Hamiltonian kinetic energy K(r):  0.3379498456E+00
 Potential energy density V(r): -0.4422621102E+00
 Energy density E(r) or H(r): -0.3379498456E+00
 Laplacian of electron density: -0.9345503241E+00
 Electron localization function (ELF):  0.9425360390E+00
 Localized orbital locator (LOL):  0.8019940243E+00
 Local information entropy:  0.4902738269E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3167056218E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2197895891E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2439938101E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5902461476E-02
 Wavefunction value for orbital         1 : -0.7561193537E-07
 Average local ionization energy (ALIE):  0.6491523982E+00
 Delta-g (under promolecular approximation):  0.3911636919E+00
 Delta-g (under Hirshfeld partition):  0.5701916075E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4705237744E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4393729304E-16  0.3830587919E-15 -0.6754579535E-16
 Norm of gradient is:  0.3914421519E-15
 
 Components of Laplacian in x/y/z are:
 -0.1575602994E+00 -0.2042398676E+00 -0.5727501571E+00
 Total: -0.9345503241E+00
 
 Hessian matrix:
 -0.1575602994E+00  0.4935882767E+00 -0.7461710905E-01
  0.4935882767E+00 -0.2042398676E+00 -0.7083553807E-01
 -0.7461710905E-01 -0.7083553807E-01 -0.5727501571E+00
 Eigenvalues of Hessian: -0.6750405216E+00 -0.5845400625E+00  0.3250302601E+00
 Eigenvectors(columns) of Hessian:
 -0.6904032360E+00  0.8054061673E-01  0.7189273821E+00
  0.7234198628E+00  0.8051737111E-01  0.6856972037E+00
 -0.2659667152E-02  0.9934939164E+00 -0.1138541355E+00
 Determinant of Hessian:  0.1282531146E+00
 Ellipticity of electron density:    0.154823
 eta index:    2.076854
 
 ----------------   CP   132,     Type (3,-1)   ----------------
 Connected atoms:    21(C )   --    22(C )
 Position (Bohr):       -8.763743439694   -4.270351173190    3.034947349132
 Position (Angstrom):   -4.637573310487   -2.259772523405    1.606024973451
 Density of all electrons:  0.3184837678E+00
 Density of Alpha electrons:  0.1592418839E+00
 Density of Beta electrons:  0.1592418839E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1055858972E+00
 G(r) in X,Y,Z:  0.2412364002E-01  0.3185204264E-01  0.4961021457E-01
 Hamiltonian kinetic energy K(r):  0.3408025167E+00
 Potential energy density V(r): -0.4463884139E+00
 Energy density E(r) or H(r): -0.3408025167E+00
 Laplacian of electron density: -0.9408664778E+00
 Electron localization function (ELF):  0.9422316128E+00
 Localized orbital locator (LOL):  0.8015482891E+00
 Local information entropy:  0.4926486914E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3184837678E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2196630940E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8185238877E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7332973101E-02
 Wavefunction value for orbital         1 : -0.5695381556E-06
 Average local ionization energy (ALIE):  0.6510183390E+00
 Delta-g (under promolecular approximation):  0.3790632872E+00
 Delta-g (under Hirshfeld partition):  0.5720466409E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5262413175E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3020815951E-16  0.1614021281E-16  0.4040855378E-16
 Norm of gradient is:  0.5297065782E-16
 
 Components of Laplacian in x/y/z are:
 -0.2631866426E+00 -0.2257141926E+00 -0.4519656427E+00
 Total: -0.9408664778E+00
 
 Hessian matrix:
 -0.2631866426E+00 -0.4232551409E+00  0.2706254329E+00
 -0.4232551409E+00 -0.2257141926E+00 -0.2104779028E+00
  0.2706254329E+00 -0.2104779028E+00 -0.4519656427E+00
 Eigenvalues of Hessian: -0.6914476738E+00 -0.5767327785E+00  0.3273139745E+00
 Eigenvectors(columns) of Hessian:
  0.7584864002E+00  0.6980664872E-01  0.6479393586E+00
  0.5009054464E+00  0.5735689241E+00 -0.6481608003E+00
 -0.4168838141E+00  0.8161775059E+00  0.4000776980E+00
 Determinant of Hessian:  0.1305264429E+00
 Ellipticity of electron density:    0.198905
 eta index:    2.112491
 
 ----------------   CP   133,     Type (3,-1)   ----------------
 Connected atoms:    50(H )   --    67(N )
 Position (Bohr):       -3.888274019271   -4.841462303164    2.171690408230
 Position (Angstrom):   -2.057586000744   -2.561991518280    1.149209073172
 Density of all electrons:  0.3728192786E-02
 Density of Alpha electrons:  0.1864096393E-02
 Density of Beta electrons:  0.1864096393E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2511877316E-02
 G(r) in X,Y,Z:  0.1753339884E-02  0.2250451658E-03  0.5334922662E-03
 Hamiltonian kinetic energy K(r): -0.6191224374E-03
 Potential energy density V(r): -0.1892754878E-02
 Energy density E(r) or H(r):  0.6191224374E-03
 Laplacian of electron density:  0.1252399901E-01
 Electron localization function (ELF):  0.1030822210E-01
 Localized orbital locator (LOL):  0.9294015167E-01
 Local information entropy:  0.9280048970E-04
 Reduced density gradient (RDG):  0.2765455526E-14
 Reduced density gradient with promolecular approximation:  0.2262825486E+00
 Sign(lambda2)*rho: -0.3728192786E-02
 Sign(lambda2)*rho with promolecular approximation: -0.8119818446E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4956022527E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1515012694E-03
 Wavefunction value for orbital         1 : -0.1042080775E-05
 Average local ionization energy (ALIE):  0.5176213443E+00
 Delta-g (under promolecular approximation):  0.1008845175E-01
 Delta-g (under Hirshfeld partition):  0.7083668872E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5183325482E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.9453734724E-17  0.7445419606E-18  0.3721545133E-17
 Norm of gradient is:  0.1018711643E-16
 
 Components of Laplacian in x/y/z are:
  0.1297221418E-01 -0.1732943933E-02  0.1284728764E-02
 Total:  0.1252399901E-01
 
 Hessian matrix:
  0.1297221418E-01  0.6312053077E-03 -0.6176030853E-02
  0.6312053077E-03 -0.1732943933E-02  0.5805661672E-03
 -0.6176030853E-02  0.5805661672E-03  0.1284728764E-02
 Eigenvalues of Hessian: -0.2360812035E-02 -0.7532457207E-03  0.1563805677E-01
 Eigenvectors(columns) of Hessian:
 -0.2597272204E+00  0.2975961675E+00 -0.9186829116E+00
  0.7833192465E+00  0.6212914020E+00 -0.2019781819E-01
 -0.5647590008E+00  0.7248679293E+00  0.3944790946E+00
 Determinant of Hessian:  0.2780871165E-07
 Ellipticity of electron density:    2.134186
 eta index:    0.150966
 
 ----------------   CP   134,     Type (3,+1)   ----------------
 Position (Bohr):       -4.594644948803   -5.459356897050   -0.984608934163
 Position (Angstrom):   -2.431381399097   -2.888967256105   -0.521032609610
 Density of all electrons:  0.2681113933E-02
 Density of Alpha electrons:  0.1340556966E-02
 Density of Beta electrons:  0.1340556966E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1691159187E-02
 G(r) in X,Y,Z:  0.8897395341E-03  0.5177876558E-03  0.2836319975E-03
 Hamiltonian kinetic energy K(r): -0.5553015217E-03
 Potential energy density V(r): -0.1135857666E-02
 Energy density E(r) or H(r):  0.5553015217E-03
 Laplacian of electron density:  0.8985842836E-02
 Electron localization function (ELF):  0.7569460922E-02
 Localized orbital locator (LOL):  0.8075580956E-01
 Local information entropy:  0.6860982999E-04
 Reduced density gradient (RDG):  0.1335063138E-14
 Reduced density gradient with promolecular approximation:  0.3208283403E+00
 Sign(lambda2)*rho:  0.2681113933E-02
 Sign(lambda2)*rho with promolecular approximation:  0.5214276239E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1972642038E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.9927248725E-04
 Wavefunction value for orbital         1 : -0.6720517403E-05
 Average local ionization energy (ALIE):  0.4924106555E+00
 Delta-g (under promolecular approximation):  0.6307527901E-02
 Delta-g (under Hirshfeld partition):  0.5235023975E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5214476021E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.6013933926E-19  0.2831631143E-17 -0.1006063383E-17
 Norm of gradient is:  0.3005647218E-17
 
 Components of Laplacian in x/y/z are:
  0.6120215388E-02  0.2336379743E-02  0.5292477051E-03
 Total:  0.8985842836E-02
 
 Hessian matrix:
  0.6120215388E-02 -0.5886124844E-03  0.2697636884E-02
 -0.5886124844E-03  0.2336379743E-02 -0.1397309972E-02
  0.2697636884E-02 -0.1397309972E-02  0.5292477051E-03
 Eigenvalues of Hessian: -0.9299709054E-03  0.2475805743E-02  0.7440007999E-02
 Eigenvectors(columns) of Hessian:
 -0.3141809027E+00  0.3153266276E+00 -0.8954660676E+00
  0.3249753135E+00  0.9219666396E+00  0.2106384604E+00
  0.8920097567E+00 -0.2248257844E+00 -0.3921376808E+00
 Determinant of Hessian: -0.1713007759E-07
 Ellipticity of electron density:   -1.375624
 eta index:    0.124996
 
 ----------------   CP   135,     Type (3,-1)   ----------------
 Connected atoms:    12(C )   --    11(C )
 Position (Bohr):        6.319274545627   -6.448781850940   -0.157399928638
 Position (Angstrom):    3.344016078985   -3.412548393602   -0.083292455233
 Density of all electrons:  0.3203845681E+00
 Density of Alpha electrons:  0.1601922840E+00
 Density of Beta electrons:  0.1601922840E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1068561420E+00
 G(r) in X,Y,Z:  0.3785567827E-01  0.7120360304E-02  0.6188010341E-01
 Hamiltonian kinetic energy K(r):  0.3452874536E+00
 Potential energy density V(r): -0.4521435956E+00
 Energy density E(r) or H(r): -0.3452874536E+00
 Laplacian of electron density: -0.9537252466E+00
 Electron localization function (ELF):  0.9420091372E+00
 Localized orbital locator (LOL):  0.8012234172E+00
 Local information entropy:  0.4951850455E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3203845681E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2219285029E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3827211164E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8404566120E-02
 Wavefunction value for orbital         1 : -0.1587551389E-07
 Average local ionization energy (ALIE):  0.6524541511E+00
 Delta-g (under promolecular approximation):  0.3931314662E+00
 Delta-g (under Hirshfeld partition):  0.5751560734E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5265071208E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1811248668E-15  0.2120360636E-15 -0.2184667378E-16
 Norm of gradient is:  0.2797191212E-15
 
 Components of Laplacian in x/y/z are:
 -0.6335008648E+00  0.2686517272E+00 -0.5888761090E+00
 Total: -0.9537252466E+00
 
 Hessian matrix:
 -0.6335008648E+00 -0.2210997544E+00  0.2206926251E-01
 -0.2210997544E+00  0.2686517272E+00 -0.5265001460E-01
  0.2206926251E-01 -0.5265001460E-01 -0.5888761090E+00
 Eigenvalues of Hessian: -0.6857581805E+00 -0.5913636086E+00  0.3233965426E+00
 Eigenvectors(columns) of Hessian:
  0.9703475945E+00  0.8560206147E-01  0.2260482978E+00
  0.2191686847E+00  0.8279146695E-01 -0.9721680208E+00
 -0.1019344569E+00  0.9928836085E+00  0.6157520958E-01
 Determinant of Hessian:  0.1311477865E+00
 Ellipticity of electron density:    0.159622
 eta index:    2.120487
 
 ----------------   CP   136,     Type (3,-1)   ----------------
 Connected atoms:    69(N )   --    73(C )
 Position (Bohr):       -0.096535751176   -4.784215811269    2.886333793211
 Position (Angstrom):   -0.051084519559   -2.531697979365    1.527382066426
 Density of all electrons:  0.3402761098E+00
 Density of Alpha electrons:  0.1701380549E+00
 Density of Beta electrons:  0.1701380549E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2293163436E+00
 G(r) in X,Y,Z:  0.9126105287E-01  0.7056320969E-01  0.6749208101E-01
 Hamiltonian kinetic energy K(r):  0.5158328431E+00
 Potential energy density V(r): -0.7451491867E+00
 Energy density E(r) or H(r): -0.5158328431E+00
 Laplacian of electron density: -0.1146065998E+01
 Electron localization function (ELF):  0.8117430215E+00
 Localized orbital locator (LOL):  0.6749657848E+00
 Local information entropy:  0.5215868199E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3402761098E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2871787076E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3751748534E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1632003115E-01
 Wavefunction value for orbital         1 :  0.7055382147E-07
 Average local ionization energy (ALIE):  0.9091906713E+00
 Delta-g (under promolecular approximation):  0.3511529063E+00
 Delta-g (under Hirshfeld partition):  0.4997278859E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5920901198E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1089407190E-15  0.1959801306E-15  0.2655075595E-15
 Norm of gradient is:  0.3475205836E-15
 
 Components of Laplacian in x/y/z are:
 -0.5113304540E+00 -0.4108646116E+00 -0.2238709326E+00
 Total: -0.1146065998E+01
 
 Hessian matrix:
 -0.5113304540E+00 -0.2571641335E+00  0.3233244640E+00
 -0.2571641335E+00 -0.4108646116E+00 -0.4870672789E+00
  0.3233244640E+00 -0.4870672789E+00 -0.2238709326E+00
 Eigenvalues of Hessian: -0.8137827702E+00 -0.7040782074E+00  0.3717949795E+00
 Eigenvectors(columns) of Hessian:
 -0.5892873565E-01 -0.9038908100E+00 -0.4236847976E+00
  0.7536860292E+00 -0.3185902946E+00  0.5748544107E+00
  0.6545874834E+00  0.2854498691E+00 -0.7000239987E+00
 Determinant of Hessian:  0.2130261477E+00
 Ellipticity of electron density:    0.155813
 eta index:    2.188794
 
 ----------------   CP   137,     Type (3,-1)   ----------------
 Connected atoms:    23(C )   --    22(C )
 Position (Bohr):      -10.972880691040   -3.523822813738    2.749920993651
 Position (Angstrom):   -5.806598399656   -1.864726728290    1.455195521624
 Density of all electrons:  0.3196703539E+00
 Density of Alpha electrons:  0.1598351770E+00
 Density of Beta electrons:  0.1598351770E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1062384659E+00
 G(r) in X,Y,Z:  0.7607489883E-02  0.4546148766E-01  0.5316948836E-01
 Hamiltonian kinetic energy K(r):  0.3431150847E+00
 Potential energy density V(r): -0.4493535506E+00
 Energy density E(r) or H(r): -0.3431150847E+00
 Laplacian of electron density: -0.9475064752E+00
 Electron localization function (ELF):  0.9422356590E+00
 Localized orbital locator (LOL):  0.8015541089E+00
 Local information entropy:  0.4942323068E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3196703539E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2202704284E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.7676517656E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6363767208E-02
 Wavefunction value for orbital         1 :  0.2280601679E-06
 Average local ionization energy (ALIE):  0.6516894596E+00
 Delta-g (under promolecular approximation):  0.3793702931E+00
 Delta-g (under Hirshfeld partition):  0.5736002327E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4956006303E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4447293550E-15  0.1272031729E-16 -0.2863818395E-17
 Norm of gradient is:  0.4449204503E-15
 
 Components of Laplacian in x/y/z are:
  0.2828288145E+00 -0.6434129117E+00 -0.5869223780E+00
 Total: -0.9475064752E+00
 
 Hessian matrix:
  0.2828288145E+00  0.1126308820E+00 -0.1722824002E+00
  0.1126308820E+00 -0.6434129117E+00  0.3583487826E-01
 -0.1722824002E+00  0.3583487826E-01 -0.5869223780E+00
 Eigenvalues of Hessian: -0.6958134814E+00 -0.5785722791E+00  0.3268792852E+00
 Eigenvectors(columns) of Hessian:
  0.1920382217E+00  0.8364456197E-01  0.9778163982E+00
 -0.8007664435E+00  0.5893692049E+00  0.1068505652E+00
  0.5673574044E+00  0.8035219522E+00 -0.1801611724E+00
 Determinant of Hessian:  0.1315945369E+00
 Ellipticity of electron density:    0.202639
 eta index:    2.128656
 
 ----------------   CP   138,     Type (3,-1)   ----------------
 Connected atoms:    47(H )   --    14(C )
 Position (Bohr):       12.293255043536   -7.054584815016   -0.600657092634
 Position (Angstrom):    6.505310416858   -3.733125516489   -0.317854044989
 Density of all electrons:  0.2899364419E+00
 Density of Alpha electrons:  0.1449682210E+00
 Density of Beta electrons:  0.1449682210E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3424642853E-01
 G(r) in X,Y,Z:  0.4109450205E-02  0.1428569640E-01  0.1585128192E-01
 Hamiltonian kinetic energy K(r):  0.2977484960E+00
 Potential energy density V(r): -0.3319949246E+00
 Energy density E(r) or H(r): -0.2977484960E+00
 Laplacian of electron density: -0.1054008270E+01
 Electron localization function (ELF):  0.9912530727E+00
 Localized orbital locator (LOL):  0.9141525562E+00
 Local information entropy:  0.4542586902E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2899364419E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1810147999E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2595258664E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5912402209E-02
 Wavefunction value for orbital         1 : -0.7342751617E-07
 Average local ionization energy (ALIE):  0.5696174345E+00
 Delta-g (under promolecular approximation):  0.3174989470E+00
 Delta-g (under Hirshfeld partition):  0.5475189341E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4294357676E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1485018163E-15 -0.5753522116E-15 -0.7559599648E-16
 Norm of gradient is:  0.5989972550E-15
 
 Components of Laplacian in x/y/z are:
  0.4367750946E+00 -0.6967940716E+00 -0.7939892930E+00
 Total: -0.1054008270E+01
 
 Hessian matrix:
  0.4367750946E+00 -0.3697244181E+00 -0.8226911959E-01
 -0.3697244181E+00 -0.6967940716E+00  0.2568083898E-01
 -0.8226911959E-01  0.2568083898E-01 -0.7939892930E+00
 Eigenvalues of Hessian: -0.8069068481E+00 -0.7993217368E+00  0.5522203149E+00
 Eigenvectors(columns) of Hessian:
 -0.2720306020E+00  0.1048878206E+00 -0.9565552241E+00
 -0.9496492701E+00  0.1313211108E+00  0.2844662189E+00
  0.1554529363E+00  0.9857754871E+00  0.6388328146E-01
 Determinant of Hessian:  0.3561700555E+00
 Ellipticity of electron density:    0.009489
 eta index:    1.461205
 
 ----------------   CP   139,     Type (3,-1)   ----------------
 Connected atoms:    67(N )   --    73(C )
 Position (Bohr):       -0.716772176392   -4.630636419588    1.404330231973
 Position (Angstrom):   -0.379299501156   -2.450427265223    0.743139555342
 Density of all electrons:  0.3479158845E+00
 Density of Alpha electrons:  0.1739579423E+00
 Density of Beta electrons:  0.1739579423E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2358695879E+00
 G(r) in X,Y,Z:  0.9643743125E-01  0.7069302212E-01  0.6873913451E-01
 Hamiltonian kinetic energy K(r):  0.5327156888E+00
 Potential energy density V(r): -0.7685852767E+00
 Energy density E(r) or H(r): -0.5327156888E+00
 Laplacian of electron density: -0.1187384404E+01
 Electron localization function (ELF):  0.8144269789E+00
 Localized orbital locator (LOL):  0.6768997547E+00
 Local information entropy:  0.5316606951E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3479158845E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2899548325E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3215696122E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1931621048E-01
 Wavefunction value for orbital         1 :  0.2663462550E-05
 Average local ionization energy (ALIE):  0.9011996290E+00
 Delta-g (under promolecular approximation):  0.3585857439E+00
 Delta-g (under Hirshfeld partition):  0.5148077352E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6109417955E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.5591095078E-16  0.3179693921E-15 -0.2386464507E-15
 Norm of gradient is:  0.4014756495E-15
 
 Components of Laplacian in x/y/z are:
 -0.6703754126E+00 -0.6479382378E+00  0.1309292467E+00
 Total: -0.1187384404E+01
 
 Hessian matrix:
 -0.6703754126E+00  0.1390217589E+00  0.2123308491E+00
  0.1390217589E+00 -0.6479382378E+00  0.4234643061E+00
  0.2123308491E+00  0.4234643061E+00  0.1309292467E+00
 Eigenvalues of Hessian: -0.8480260084E+00 -0.7160794013E+00  0.3767210061E+00
 Eigenvectors(columns) of Hessian:
 -0.3200675956E+00  0.9183489223E+00  0.2327917335E+00
  0.8928574796E+00  0.2102290547E+00  0.3982577881E+00
 -0.3168000244E+00 -0.3353192531E+00  0.8872422122E+00
 Determinant of Hessian:  0.2287653214E+00
 Ellipticity of electron density:    0.184263
 eta index:    2.251072
 
 ----------------   CP   140,     Type (3,-1)   ----------------
 Connected atoms:    23(C )   --    51(H )
 Position (Bohr):      -13.078275621016   -2.788218771168    2.467545361304
 Position (Angstrom):   -6.920725416550   -1.475461832714    1.305768772071
 Density of all electrons:  0.2863414927E+00
 Density of Alpha electrons:  0.1431707464E+00
 Density of Beta electrons:  0.1431707464E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3556391347E-01
 G(r) in X,Y,Z:  0.1069471271E-01  0.1040613568E-01  0.1446306508E-01
 Hamiltonian kinetic energy K(r):  0.2922184731E+00
 Potential energy density V(r): -0.3277823866E+00
 Energy density E(r) or H(r): -0.2922184731E+00
 Laplacian of electron density: -0.1026618239E+01
 Electron localization function (ELF):  0.9901774363E+00
 Localized orbital locator (LOL):  0.9094454133E+00
 Local information entropy:  0.4493831943E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2863414927E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1807525655E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4868489831E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6007941285E-02
 Wavefunction value for orbital         1 :  0.2171527891E-06
 Average local ionization energy (ALIE):  0.5683919446E+00
 Delta-g (under promolecular approximation):  0.3103598151E+00
 Delta-g (under Hirshfeld partition):  0.5369063560E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4275438988E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3007031814E-16 -0.3389591862E-15  0.2614348133E-15
 Norm of gradient is:  0.4291220288E-15
 
 Components of Laplacian in x/y/z are:
 -0.2357871657E+00 -0.2135380551E+00 -0.5772930177E+00
 Total: -0.1026618239E+01
 
 Hessian matrix:
 -0.2357871657E+00 -0.5586616412E+00  0.3341787532E+00
 -0.5586616412E+00 -0.2135380551E+00 -0.3357362920E+00
  0.3341787532E+00 -0.3357362920E+00 -0.5772930177E+00
 Eigenvalues of Hessian: -0.7851923062E+00 -0.7771371320E+00  0.5357111998E+00
 Eigenvectors(columns) of Hessian:
  0.7588817598E+00  0.9064912656E-01  0.6448885256E+00
  0.4891177541E+00  0.5744571927E+00 -0.6563251910E+00
 -0.4299561574E+00  0.8134996432E+00  0.3916069882E+00
 Determinant of Hessian:  0.3268920975E+00
 Ellipticity of electron density:    0.010365
 eta index:    1.465701
 
 ----------------   CP   141,     Type (3,-1)   ----------------
 Connected atoms:    64(Cl)   --    19(C )
 Position (Bohr):       -6.566629552467   -5.506556166542   -5.007198999954
 Position (Angstrom):   -3.474910711607   -2.913944033891   -2.649695601232
 Density of all electrons:  0.1936884959E+00
 Density of Alpha electrons:  0.9684424794E-01
 Density of Beta electrons:  0.9684424794E-01
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6469095846E-01
 G(r) in X,Y,Z:  0.2496904565E-01  0.1741555615E-01  0.2230635666E-01
 Hamiltonian kinetic energy K(r):  0.1354405062E+00
 Potential energy density V(r): -0.2001314646E+00
 Energy density E(r) or H(r): -0.1354405062E+00
 Laplacian of electron density: -0.2829981909E+00
 Electron localization function (ELF):  0.8922335936E+00
 Localized orbital locator (LOL):  0.7421236306E+00
 Local information entropy:  0.3200161990E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1936884959E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1611615792E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5277394767E-09
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2268939925E-02
 Wavefunction value for orbital         1 : -0.2023824889E-04
 Average local ionization energy (ALIE):  0.6948352342E+00
 Delta-g (under promolecular approximation):  0.2882659789E+00
 Delta-g (under Hirshfeld partition):  0.3784857827E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5285352965E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3801134466E-16 -0.1262955771E-15 -0.1244579391E-15
 Norm of gradient is:  0.1813428071E-15
 
 Components of Laplacian in x/y/z are:
 -0.3045426272E+00  0.2027127110E+00 -0.1811682747E+00
 Total: -0.2829981909E+00
 
 Hessian matrix:
 -0.3045426272E+00  0.3165100320E-01  0.2876213902E-01
  0.3165100320E-01  0.2027127110E+00  0.2611935625E+00
  0.2876213902E-01  0.2611935625E+00 -0.1811682747E+00
 Eigenvalues of Hessian: -0.3220353051E+00 -0.2985177303E+00  0.3375548446E+00
 Eigenvectors(columns) of Hessian:
 -0.6060567662E+00  0.7928346778E+00  0.6409656617E-01
 -0.3248442624E+00 -0.3202599039E+00  0.8898931392E+00
  0.7260657004E+00  0.5185043564E+00  0.4516434778E+00
 Determinant of Hessian:  0.3245024371E-01
 Ellipticity of electron density:    0.078781
 eta index:    0.954024
 
 ----------------   CP   142,     Type (3,+1)   ----------------
 Position (Bohr):        8.515852596572   -5.892785143356   -0.374942200871
 Position (Angstrom):    4.506395125515   -3.118327606612   -0.198410868107
 Density of all electrons:  0.2428635941E-01
 Density of Alpha electrons:  0.1214317970E-01
 Density of Beta electrons:  0.1214317970E-01
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3345101383E-01
 G(r) in X,Y,Z:  0.1542344761E-01  0.1438082453E-01  0.3646741688E-02
 Hamiltonian kinetic energy K(r): -0.4505926600E-02
 Potential energy density V(r): -0.2894508723E-01
 Energy density E(r) or H(r):  0.4505926600E-02
 Laplacian of electron density:  0.1518277617E+00
 Electron localization function (ELF):  0.2963923163E-01
 Localized orbital locator (LOL):  0.1488073932E+00
 Local information entropy:  0.5081004520E-03
 Reduced density gradient (RDG):  0.3295654067E-15
 Reduced density gradient with promolecular approximation:  0.4971253916E-02
 Sign(lambda2)*rho:  0.2428635941E-01
 Sign(lambda2)*rho with promolecular approximation:  0.5783691740E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2480467375E-07
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1165920724E-02
 Wavefunction value for orbital         1 : -0.2686574910E-06
 Average local ionization energy (ALIE):  0.7814644662E+00
 Delta-g (under promolecular approximation):  0.9167654534E-01
 Delta-g (under Hirshfeld partition):  0.4936072527E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4971315878E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1462148274E-16  0.6840638082E-17  0.2574980160E-18
 Norm of gradient is:  0.1614460876E-16
 
 Components of Laplacian in x/y/z are:
  0.8773834398E-01  0.7939479974E-01 -0.1530538200E-01
 Total:  0.1518277617E+00
 
 Hessian matrix:
  0.8773834398E-01 -0.1791024421E-02 -0.8253454885E-02
 -0.1791024421E-02  0.7939479974E-01 -0.7652171748E-02
 -0.8253454885E-02 -0.7652171748E-02 -0.1530538200E-01
 Eigenvalues of Hessian: -0.1659135394E-01  0.7986216200E-01  0.8855695365E-01
 Eigenvectors(columns) of Hessian:
  0.7998240641E-01  0.1295633234E+00 -0.9883401034E+00
  0.8069778083E-01  0.9874204407E+00  0.1359733113E+00
  0.9935243746E+00 -0.9063232570E-01  0.6852079031E-01
 Determinant of Hessian: -0.1173398583E-03
 Ellipticity of electron density:   -1.207750
 eta index:    0.187352
 
 ----------------   CP   143,     Type (3,-1)   ----------------
 Connected atoms:    67(N )   --    44(H )
 Position (Bohr):        2.102779562772   -4.704871033018    0.220142183912
 Position (Angstrom):    1.112743024171   -2.489710530911    0.116494226885
 Density of all electrons:  0.6618400260E-02
 Density of Alpha electrons:  0.3309200130E-02
 Density of Beta electrons:  0.3309200130E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4534124587E-02
 G(r) in X,Y,Z:  0.3843132000E-02  0.1811791723E-03  0.5098134154E-03
 Hamiltonian kinetic energy K(r): -0.1018378140E-02
 Potential energy density V(r): -0.3515746448E-02
 Energy density E(r) or H(r):  0.1018378140E-02
 Laplacian of electron density:  0.2221001091E-01
 Electron localization function (ELF):  0.2126882827E-01
 Localized orbital locator (LOL):  0.1287222123E+00
 Local information entropy:  0.1566945604E-03
 Reduced density gradient (RDG):  0.1543638162E-14
 Reduced density gradient with promolecular approximation:  0.2794723085E+00
 Sign(lambda2)*rho: -0.6618400260E-02
 Sign(lambda2)*rho with promolecular approximation: -0.1264894042E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6379856453E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.3426490044E-03
 Wavefunction value for orbital         1 : -0.1721619816E-05
 Average local ionization energy (ALIE):  0.5269015142E+00
 Delta-g (under promolecular approximation):  0.1524488273E-01
 Delta-g (under Hirshfeld partition):  0.1238759919E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5347496350E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1143039199E-16 -0.1063026349E-17  0.7763056962E-18
 Norm of gradient is:  0.1150593484E-16
 
 Components of Laplacian in x/y/z are:
  0.2956218516E-01 -0.5166731549E-02 -0.2185442704E-02
 Total:  0.2221001091E-01
 
 Hessian matrix:
  0.2956218516E-01  0.1576045222E-02 -0.4198081647E-02
  0.1576045222E-02 -0.5166731549E-02  0.4479574236E-03
 -0.4198081647E-02  0.4479574236E-03 -0.2185442704E-02
 Eigenvalues of Hessian: -0.5388289191E-02 -0.2573758510E-02  0.3017205861E-01
 Eigenvectors(columns) of Hessian:
 -0.7131013384E-01  0.1144651122E+00 -0.9908645734E+00
  0.9707541575E+00  0.2362716171E+00 -0.4256863436E-01
 -0.2292405516E+00  0.9649214792E+00  0.1279660442E+00
 Determinant of Hessian:  0.4184307904E-06
 Ellipticity of electron density:    1.093549
 eta index:    0.178585
 
 ----------------   CP   144,     Type (3,-1)   ----------------
 Connected atoms:    67(N )   --    89(H )
 Position (Bohr):       -1.664094636451   -4.301837575692   -0.937739478675
 Position (Angstrom):   -0.880600958396   -2.276434410063   -0.496230361879
 Density of all electrons:  0.3398071178E+00
 Density of Alpha electrons:  0.1699035589E+00
 Density of Beta electrons:  0.1699035589E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4803427133E-01
 G(r) in X,Y,Z:  0.2411629342E-01  0.1114653824E-01  0.1277143967E-01
 Hamiltonian kinetic energy K(r):  0.5250868630E+00
 Potential energy density V(r): -0.5731211344E+00
 Energy density E(r) or H(r): -0.5250868630E+00
 Laplacian of electron density: -0.1908210367E+01
 Electron localization function (ELF):  0.9898775429E+00
 Localized orbital locator (LOL):  0.9081806762E+00
 Local information entropy:  0.5209672272E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3398071178E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2147941520E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5803382895E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3226165607E-01
 Wavefunction value for orbital         1 : -0.2121963538E-05
 Average local ionization energy (ALIE):  0.6933078892E+00
 Delta-g (under promolecular approximation):  0.5017285793E+00
 Delta-g (under Hirshfeld partition):  0.7508322022E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5869818829E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1525201406E-15  0.6007157662E-16 -0.2731105272E-15
 Norm of gradient is:  0.3185284096E-15
 
 Components of Laplacian in x/y/z are:
 -0.9915351968E+00 -0.4444598329E+00 -0.4722153370E+00
 Total: -0.1908210367E+01
 
 Hessian matrix:
 -0.9915351968E+00 -0.5624637383E+00  0.5419445534E+00
 -0.5624637383E+00 -0.4444598329E+00 -0.9194429228E+00
  0.5419445534E+00 -0.9194429228E+00 -0.4722153370E+00
 Eigenvalues of Hessian: -0.1379205467E+01 -0.1330436873E+01  0.8014319736E+00
 Eigenvectors(columns) of Hessian:
  0.1511545903E+00 -0.9042457279E+00 -0.3993644368E+00
  0.7379245668E+00 -0.1656006792E+00  0.6542505245E+00
  0.6577382637E+00  0.3935937990E+00 -0.6422338343E+00
 Determinant of Hessian:  0.1470584241E+01
 Ellipticity of electron density:    0.036656
 eta index:    1.720926
 
 ----------------   CP   145,     Type (3,-1)   ----------------
 Connected atoms:    22(C )   --    63(N )
 Position (Bohr):       -9.307489832439   -2.610327571303    1.947167259108
 Position (Angstrom):   -4.925311510038   -1.381325863725    1.030396539336
 Density of all electrons:  0.2727231082E+00
 Density of Alpha electrons:  0.1363615541E+00
 Density of Beta electrons:  0.1363615541E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1460129232E+00
 G(r) in X,Y,Z:  0.5876974628E-01  0.3833341630E-01  0.4890976066E-01
 Hamiltonian kinetic energy K(r):  0.3313860142E+00
 Potential energy density V(r): -0.4773989374E+00
 Energy density E(r) or H(r): -0.3313860142E+00
 Laplacian of electron density: -0.7414923638E+00
 Electron localization function (ELF):  0.8356858947E+00
 Localized orbital locator (LOL):  0.6928133233E+00
 Local information entropy:  0.4308260814E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2727231082E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2423942211E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.9472880739E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5983927450E-02
 Wavefunction value for orbital         1 :  0.1653706577E-05
 Average local ionization energy (ALIE):  0.7786995552E+00
 Delta-g (under promolecular approximation):  0.2887042612E+00
 Delta-g (under Hirshfeld partition):  0.4032256274E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5424195116E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3658615879E-15  0.9718009004E-16 -0.1001971155E-15
 Norm of gradient is:  0.3915841332E-15
 
 Components of Laplacian in x/y/z are:
 -0.4388945991E+00 -0.2316712611E-01 -0.2794306386E+00
 Total: -0.7414923638E+00
 
 Hessian matrix:
 -0.4388945991E+00  0.2256526941E+00 -0.1518378429E+00
  0.2256526941E+00 -0.2316712611E-01 -0.3787888222E+00
 -0.1518378429E+00 -0.3787888222E+00 -0.2794306386E+00
 Eigenvalues of Hessian: -0.5540580419E+00 -0.5305296046E+00  0.3430952826E+00
 Eigenvectors(columns) of Hessian:
  0.3312532843E+00 -0.8845481833E+00 -0.3283988017E+00
 -0.6372633964E+00  0.4693232807E-01 -0.7692156526E+00
 -0.6958208284E+00 -0.4640817470E+00  0.5481436918E+00
 Determinant of Hessian:  0.1008508663E+00
 Ellipticity of electron density:    0.044349
 eta index:    1.614881
 
 ----------------   CP   146,     Type (3,-1)   ----------------
 Connected atoms:    11(C )   --    44(H )
 Position (Bohr):        4.752576603102   -4.762828025178   -0.144151232834
 Position (Angstrom):    2.514955231432   -2.520380050374   -0.076281547339
 Density of all electrons:  0.2892518168E+00
 Density of Alpha electrons:  0.1446259084E+00
 Density of Beta electrons:  0.1446259084E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3574745351E-01
 G(r) in X,Y,Z:  0.4564985778E-02  0.1454751809E-01  0.1663494964E-01
 Hamiltonian kinetic energy K(r):  0.2973395749E+00
 Potential energy density V(r): -0.3330870284E+00
 Energy density E(r) or H(r): -0.2973395749E+00
 Laplacian of electron density: -0.1046368485E+01
 Electron localization function (ELF):  0.9904025888E+00
 Localized orbital locator (LOL):  0.9104048955E+00
 Local information entropy:  0.4533309282E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2892518168E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1818043195E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5829875245E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1237264706E-01
 Wavefunction value for orbital         1 : -0.1350157555E-06
 Average local ionization energy (ALIE):  0.5732681155E+00
 Delta-g (under promolecular approximation):  0.3151951882E+00
 Delta-g (under Hirshfeld partition):  0.5439299336E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5476425995E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3209780532E-15  0.9007687174E-16 -0.1355252716E-16
 Norm of gradient is:  0.3336531499E-15
 
 Components of Laplacian in x/y/z are:
  0.4206571442E+00 -0.6787092176E+00 -0.7883164120E+00
 Total: -0.1046368485E+01
 
 Hessian matrix:
  0.4206571442E+00 -0.3878656041E+00 -0.8493342834E-01
 -0.3878656041E+00 -0.6787092176E+00  0.2709987374E-01
 -0.8493342834E-01  0.2709987374E-01 -0.7883164120E+00
 Eigenvalues of Hessian: -0.8017778725E+00 -0.7942540084E+00  0.5496633955E+00
 Eigenvectors(columns) of Hessian:
  0.3011705454E+00  0.6914618694E-01  0.9510599915E+00
  0.9533791451E+00 -0.1865392576E-02 -0.3017693257E+00
 -0.1909209796E-01  0.9976047941E+00 -0.6648433389E-01
 Determinant of Hessian:  0.3500340541E+00
 Ellipticity of electron density:    0.009473
 eta index:    1.458671
 
 ----------------   CP   147,     Type (3,-1)   ----------------
 Connected atoms:    14(C )   --    15(C )
 Position (Bohr):       10.734161986648   -5.436070776933   -0.585358794693
 Position (Angstrom):    5.680273901475   -2.876644772008   -0.309758534353
 Density of all electrons:  0.3161588166E+00
 Density of Alpha electrons:  0.1580794083E+00
 Density of Beta electrons:  0.1580794083E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1094931868E+00
 G(r) in X,Y,Z:  0.3822900207E-01  0.7453247787E-02  0.6381093696E-01
 Hamiltonian kinetic energy K(r):  0.3390424232E+00
 Potential energy density V(r): -0.4485356100E+00
 Energy density E(r) or H(r): -0.3390424232E+00
 Laplacian of electron density: -0.9181969454E+00
 Electron localization function (ELF):  0.9367142665E+00
 Localized orbital locator (LOL):  0.7937125051E+00
 Local information entropy:  0.4895430976E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3161588166E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2206466652E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2526616496E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6065529417E-02
 Wavefunction value for orbital         1 : -0.9390378036E-07
 Average local ionization energy (ALIE):  0.6649458117E+00
 Delta-g (under promolecular approximation):  0.3770961227E+00
 Delta-g (under Hirshfeld partition):  0.5655559154E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5046118159E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3282828653E-15 -0.1512394268E-15  0.5421010862E-17
 Norm of gradient is:  0.3614863638E-15
 
 Components of Laplacian in x/y/z are:
 -0.6208424948E+00  0.2721451177E+00 -0.5694995684E+00
 Total: -0.9181969454E+00
 
 Hessian matrix:
 -0.6208424948E+00 -0.2081314254E+00  0.2060305743E-01
 -0.2081314254E+00  0.2721451177E+00 -0.4658013167E-01
  0.2060305743E-01 -0.4658013167E-01 -0.5694995684E+00
 Eigenvalues of Hessian: -0.6680189664E+00 -0.5712504214E+00  0.3210724423E+00
 Eigenvectors(columns) of Hessian:
  0.9721431642E+00  0.8958870173E-01  0.2165907035E+00
  0.2100589752E+00  0.7695128895E-01 -0.9746556962E+00
 -0.1039850723E+00  0.9930016937E+00  0.5598875865E-01
 Determinant of Hessian:  0.1225232077E+00
 Ellipticity of electron density:    0.169398
 eta index:    2.080586
 
 ----------------   CP   148,     Type (3,-1)   ----------------
 Connected atoms:    73(C )   --    68(N )
 Position (Bohr):       -0.678320880092   -3.272906801448    2.377836765552
 Position (Angstrom):   -0.358951951424   -1.731947692736    1.258297027577
 Density of all electrons:  0.3513918339E+00
 Density of Alpha electrons:  0.1756959170E+00
 Density of Beta electrons:  0.1756959170E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1916535176E+00
 G(r) in X,Y,Z:  0.7945874708E-01  0.3768443321E-01  0.7451033735E-01
 Hamiltonian kinetic energy K(r):  0.4928833971E+00
 Potential energy density V(r): -0.6845369147E+00
 Energy density E(r) or H(r): -0.4928833971E+00
 Laplacian of electron density: -0.1204919518E+01
 Electron localization function (ELF):  0.8729540304E+00
 Localized orbital locator (LOL):  0.7238658190E+00
 Local information entropy:  0.5362323011E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3513918339E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2747836237E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8007937361E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2337522775E-01
 Wavefunction value for orbital         1 :  0.7859011680E-06
 Average local ionization energy (ALIE):  0.8318484126E+00
 Delta-g (under promolecular approximation):  0.4070309900E+00
 Delta-g (under Hirshfeld partition):  0.5820153231E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6163359306E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1391865715E-15  0.8244701071E-16 -0.8775938960E-16
 Norm of gradient is:  0.1840438038E-15
 
 Components of Laplacian in x/y/z are:
 -0.6998624512E+00  0.2693018552E+00 -0.7743589219E+00
 Total: -0.1204919518E+01
 
 Hessian matrix:
 -0.6998624512E+00 -0.2703449036E+00 -0.7334220808E-01
 -0.2703449036E+00  0.2693018552E+00  0.1480944222E+00
 -0.7334220808E-01  0.1480944222E+00 -0.7743589219E+00
 Eigenvalues of Hessian: -0.8198177018E+00 -0.7477556989E+00  0.3626538828E+00
 Eigenvectors(columns) of Hessian:
 -0.5688968885E+00  0.7824460008E+00  0.2532480720E+00
 -0.2945715367E-01  0.2883502528E+00 -0.9570717882E+00
 -0.8218811388E+00 -0.5519351298E+00 -0.1409929295E+00
 Determinant of Hessian:  0.2223153013E+00
 Ellipticity of electron density:    0.096371
 eta index:    2.260606
 
 ----------------   CP   149,     Type (3,-1)   ----------------
 Connected atoms:    62(N )   --    19(C )
 Position (Bohr):       -6.955115012271   -4.143890127419   -3.571026749269
 Position (Angstrom):   -3.680488363703   -2.192852219916   -1.889705975238
 Density of all electrons:  0.3741184190E+00
 Density of Alpha electrons:  0.1870592095E+00
 Density of Beta electrons:  0.1870592095E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2628112963E+00
 G(r) in X,Y,Z:  0.9756879849E-01  0.8662880340E-01  0.7861369442E-01
 Hamiltonian kinetic energy K(r):  0.5917914207E+00
 Potential energy density V(r): -0.8546027170E+00
 Energy density E(r) or H(r): -0.5917914207E+00
 Laplacian of electron density: -0.1315920497E+01
 Electron localization function (ELF):  0.8182847350E+00
 Localized orbital locator (LOL):  0.6797063725E+00
 Local information entropy:  0.5659462028E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3741184190E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2982949951E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6581035116E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1183437521E-01
 Wavefunction value for orbital         1 : -0.1905439291E-05
 Average local ionization energy (ALIE):  0.8938028978E+00
 Delta-g (under promolecular approximation):  0.3976901075E+00
 Delta-g (under Hirshfeld partition):  0.5762422983E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5726065058E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.9805253397E-16  0.2309655559E-15  0.4076329118E-15
 Norm of gradient is:  0.4786689652E-15
 
 Components of Laplacian in x/y/z are:
 -0.4907801916E+00 -0.8683932487E+00  0.4325294281E-01
 Total: -0.1315920497E+01
 
 Hessian matrix:
 -0.4907801916E+00 -0.1039772182E+00 -0.4961605466E+00
 -0.1039772182E+00 -0.8683932487E+00  0.9592675019E-01
 -0.4961605466E+00  0.9592675019E-01  0.4325294281E-01
 Eigenvalues of Hessian: -0.8977831695E+00 -0.7728885814E+00  0.3547512534E+00
 Eigenvectors(columns) of Hessian:
 -0.3434715711E+00 -0.7866288477E+00 -0.5130714724E+00
 -0.9352393422E+00  0.3363704881E+00  0.1103733102E+00
 -0.8575927179E-01 -0.5177547206E+00  0.8512199461E+00
 Determinant of Hessian:  0.2461570561E+00
 Ellipticity of electron density:    0.161595
 eta index:    2.530740
 
 ----------------   CP   150,     Type (3,+3)   ----------------
 Position (Bohr):       -4.578213468679   -3.126374848102    0.901546834715
 Position (Angstrom):   -2.422686234274   -1.654406322356    0.477078039493
 Density of all electrons:  0.1678448612E-02
 Density of Alpha electrons:  0.8392243062E-03
 Density of Beta electrons:  0.8392243062E-03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1072526713E-02
 G(r) in X,Y,Z:  0.4912967617E-03  0.2765106745E-03  0.3047192767E-03
 Hamiltonian kinetic energy K(r): -0.3187246663E-03
 Potential energy density V(r): -0.7538020465E-03
 Energy density E(r) or H(r):  0.3187246663E-03
 Laplacian of electron density:  0.5565005517E-02
 Electron localization function (ELF):  0.3937675682E-02
 Localized orbital locator (LOL):  0.5967406640E-01
 Local information entropy:  0.4461709120E-04
 Reduced density gradient (RDG):  0.1978458119E-14
 Reduced density gradient with promolecular approximation:  0.2810584384E+00
 Sign(lambda2)*rho:  0.1678448612E-02
 Sign(lambda2)*rho with promolecular approximation:  0.3553790753E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1834633465E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.7884540582E-04
 Wavefunction value for orbital         1 : -0.1024552665E-05
 Average local ionization energy (ALIE):  0.4959275263E+00
 Delta-g (under promolecular approximation):  0.4463460296E-02
 Delta-g (under Hirshfeld partition):  0.3334860012E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5409665383E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1953152097E-17 -0.1428997522E-17  0.2021497068E-18
 Norm of gradient is:  0.2428518383E-17
 
 Components of Laplacian in x/y/z are:
  0.3242769769E-02  0.9973222311E-03  0.1324913516E-02
 Total:  0.5565005517E-02
 
 Hessian matrix:
  0.3242769769E-02 -0.1886856173E-03  0.6883094941E-03
 -0.1886856173E-03  0.9973222311E-03 -0.4453255797E-03
  0.6883094941E-03 -0.4453255797E-03  0.1324913516E-02
 Eigenvalues of Hessian:  0.6596558153E-03  0.1400390720E-02  0.3504958981E-02
 Eigenvectors(columns) of Hessian:
 -0.1117505924E+00  0.3281728068E+00 -0.9379842291E+00
  0.7684769049E+00  0.6269836816E+00  0.1278073144E+00
  0.6300436903E+00 -0.7065366741E+00 -0.3222590207E+00
 Determinant of Hessian:  0.3237796575E-08
 Ellipticity of electron density:   -0.528949
 eta index:    0.188206
 
 ----------------   CP   151,     Type (3,+1)   ----------------
 Position (Bohr):       -4.864666257032   -2.374752473928    1.614008321943
 Position (Angstrom):   -2.574270521870   -1.256664890738    0.854096422180
 Density of all electrons:  0.1794993189E-02
 Density of Alpha electrons:  0.8974965943E-03
 Density of Beta electrons:  0.8974965943E-03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1108559079E-02
 G(r) in X,Y,Z:  0.6178974319E-03  0.2304201850E-03  0.2602414623E-03
 Hamiltonian kinetic energy K(r): -0.3439722726E-03
 Potential energy density V(r): -0.7645868065E-03
 Energy density E(r) or H(r):  0.3439722726E-03
 Laplacian of electron density:  0.5810125407E-02
 Electron localization function (ELF):  0.4609869893E-02
 Localized orbital locator (LOL):  0.6425477023E-01
 Local information entropy:  0.4745982161E-04
 Reduced density gradient (RDG):  0.1549762016E-14
 Reduced density gradient with promolecular approximation:  0.6658631911E+00
 Sign(lambda2)*rho:  0.1794993189E-02
 Sign(lambda2)*rho with promolecular approximation:  0.3363915634E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1554125063E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.8184949105E-04
 Wavefunction value for orbital         1 : -0.3354128792E-05
 Average local ionization energy (ALIE):  0.4767239206E+00
 Delta-g (under promolecular approximation):  0.3343205424E-02
 Delta-g (under Hirshfeld partition):  0.3358736344E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5359462900E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1676205411E-17  0.1059426459E-17  0.1067208574E-17
 Norm of gradient is:  0.2251884353E-17
 
 Components of Laplacian in x/y/z are:
  0.4319964052E-02  0.6112456751E-03  0.8789156799E-03
 Total:  0.5810125407E-02
 
 Hessian matrix:
  0.4319964052E-02  0.6076447232E-03  0.1341501406E-02
  0.6076447232E-03  0.6112456751E-03 -0.8209674586E-03
  0.1341501406E-02 -0.8209674586E-03  0.8789156799E-03
 Eigenvalues of Hessian: -0.4723851900E-03  0.1477558002E-02  0.4804952595E-02
 Eigenvectors(columns) of Hessian:
 -0.2771303524E+00  0.1547495226E+00 -0.9482886444E+00
  0.6741116190E+00  0.7345916428E+00 -0.7712744949E-01
  0.6846694771E+00 -0.6606267506E+00 -0.3078960921E+00
 Determinant of Hessian: -0.3353744079E-08
 Ellipticity of electron density:   -1.319707
 eta index:    0.098312
 
 ----------------   CP   152,     Type (3,-1)   ----------------
 Connected atoms:    11(C )   --    16(C )
 Position (Bohr):        6.924553790287   -4.271578454022   -0.389190993802
 Position (Angstrom):    3.664316061492   -2.260421972453   -0.205951004609
 Density of all electrons:  0.3119177005E+00
 Density of Alpha electrons:  0.1559588503E+00
 Density of Beta electrons:  0.1559588503E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1032686810E+00
 G(r) in X,Y,Z:  0.2183532123E-01  0.2198764626E-01  0.5944571353E-01
 Hamiltonian kinetic energy K(r):  0.3291824257E+00
 Potential energy density V(r): -0.4324511067E+00
 Energy density E(r) or H(r): -0.3291824257E+00
 Laplacian of electron density: -0.9036549786E+00
 Electron localization function (ELF):  0.9408521662E+00
 Localized orbital locator (LOL):  0.7995476967E+00
 Local information entropy:  0.4838686038E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3119177005E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2169530967E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1795249918E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8828382952E-02
 Wavefunction value for orbital         1 :  0.5970954381E-07
 Average local ionization energy (ALIE):  0.6605997129E+00
 Delta-g (under promolecular approximation):  0.3729810002E+00
 Delta-g (under Hirshfeld partition):  0.5614104132E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5607448360E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5300393371E-16  0.3041187094E-16 -0.1257674520E-16
 Norm of gradient is:  0.6238968987E-16
 
 Components of Laplacian in x/y/z are:
 -0.1667529172E+00 -0.1813894552E+00 -0.5555126063E+00
 Total: -0.9036549786E+00
 
 Hessian matrix:
 -0.1667529172E+00  0.4891812983E+00 -0.6864134358E-01
  0.4891812983E+00 -0.1813894552E+00 -0.6746530167E-01
 -0.6864134358E-01 -0.6746530167E-01 -0.5555126063E+00
 Eigenvalues of Hessian: -0.6633073499E+00 -0.5660246196E+00  0.3256769908E+00
 Eigenvectors(columns) of Hessian:
 -0.7018773629E+00  0.7654601086E-01  0.7081729137E+00
  0.7122969019E+00  0.7701202439E-01  0.6976405032E+00
 -0.1136232170E-02  0.9940874490E+00 -0.1085764830E+00
 Determinant of Hessian:  0.1222748694E+00
 Ellipticity of electron density:    0.171870
 eta index:    2.036703
 
 ----------------   CP   153,     Type (3,-1)   ----------------
 Connected atoms:    89(H )   --    61(N )
 Position (Bohr):       -3.304867141510   -3.663956001736   -2.722473333119
 Position (Angstrom):   -1.748860376349   -1.938882017870   -1.440670845178
 Density of all electrons:  0.3755612421E-02
 Density of Alpha electrons:  0.1877806210E-02
 Density of Beta electrons:  0.1877806210E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2701310205E-02
 G(r) in X,Y,Z:  0.1037259667E-02  0.3350353843E-03  0.1329015153E-02
 Hamiltonian kinetic energy K(r): -0.7936402675E-03
 Potential energy density V(r): -0.1907669937E-02
 Energy density E(r) or H(r):  0.7936402675E-03
 Laplacian of electron density:  0.1397980189E-01
 Electron localization function (ELF):  0.9149334799E-02
 Localized orbital locator (LOL):  0.8796444668E-01
 Local information entropy:  0.9342470130E-04
 Reduced density gradient (RDG):  0.9484901540E-15
 Reduced density gradient with promolecular approximation:  0.3922149895E+00
 Sign(lambda2)*rho: -0.3755612421E-02
 Sign(lambda2)*rho with promolecular approximation: -0.9665696716E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4718736274E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1974061166E-03
 Wavefunction value for orbital         1 : -0.1013362282E-04
 Average local ionization energy (ALIE):  0.5637050248E+00
 Delta-g (under promolecular approximation):  0.1006879894E-01
 Delta-g (under Hirshfeld partition):  0.6561008268E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5409155428E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.9567237139E-18  0.1592421941E-17 -0.2341199066E-17
 Norm of gradient is:  0.2988702222E-17
 
 Components of Laplacian in x/y/z are:
  0.6057859481E-02 -0.5194093716E-03  0.8441351780E-02
 Total:  0.1397980189E-01
 
 Hessian matrix:
  0.6057859481E-02 -0.2243962890E-02  0.9066218649E-02
 -0.2243962890E-02 -0.5194093716E-03 -0.3677489034E-02
  0.9066218649E-02 -0.3677489034E-02  0.8441351780E-02
 Eigenvalues of Hessian: -0.2452208715E-02 -0.9686635775E-03  0.1740067418E-01
 Eigenvectors(columns) of Hessian:
 -0.5056711960E+00  0.5840649223E+00  0.6349526030E+00
  0.5973250325E+00  0.7680692629E+00 -0.2308081737E+00
  0.6224945358E+00 -0.2625600390E+00  0.7372671014E+00
 Determinant of Hessian:  0.4133295708E-07
 Ellipticity of electron density:    1.531538
 eta index:    0.140926
 
 ----------------   CP   154,     Type (3,-1)   ----------------
 Connected atoms:    44(H )   --    87(H )
 Position (Bohr):        4.007193704224   -3.124448070386    1.979391304228
 Position (Angstrom):    2.120515587949   -1.653386715498    1.047448769657
 Density of all electrons:  0.4245736288E-02
 Density of Alpha electrons:  0.2122868144E-02
 Density of Beta electrons:  0.2122868144E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2900439790E-02
 G(r) in X,Y,Z:  0.3346650607E-03  0.1062877299E-02  0.1502897431E-02
 Hamiltonian kinetic energy K(r): -0.7317544421E-03
 Potential energy density V(r): -0.2168685348E-02
 Energy density E(r) or H(r):  0.7317544421E-03
 Laplacian of electron density:  0.1452877693E-01
 Electron localization function (ELF):  0.1191762753E-01
 Localized orbital locator (LOL):  0.9926376160E-01
 Local information entropy:  0.1045136473E-03
 Reduced density gradient (RDG):  0.1111417514E-14
 Reduced density gradient with promolecular approximation:  0.2727350599E+00
 Sign(lambda2)*rho: -0.4245736288E-02
 Sign(lambda2)*rho with promolecular approximation: -0.1087629626E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1227222818E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2120142316E-03
 Wavefunction value for orbital         1 :  0.4984292847E-06
 Average local ionization energy (ALIE):  0.5654512709E+00
 Delta-g (under promolecular approximation):  0.1335040912E-01
 Delta-g (under Hirshfeld partition):  0.7837824404E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5329714856E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.7352245982E-18 -0.3022213556E-17 -0.3165573882E-17
 Norm of gradient is:  0.4437926091E-17
 
 Components of Laplacian in x/y/z are:
 -0.8180214185E-03  0.5498676114E-02  0.9848122235E-02
 Total:  0.1452877693E-01
 
 Hessian matrix:
 -0.8180214185E-03 -0.3250564500E-02 -0.4257781440E-02
 -0.3250564500E-02  0.5498676114E-02  0.9983601139E-02
 -0.4257781440E-02  0.9983601139E-02  0.9848122235E-02
 Eigenvalues of Hessian: -0.2596015553E-02 -0.2190647099E-02  0.1931543958E-01
 Eigenvectors(columns) of Hessian:
 -0.3453198839E+00  0.9025971006E+00 -0.2570460109E+00
  0.6708124624E+00  0.4289371359E+00  0.6049988213E+00
 -0.6563267617E+00 -0.3648845517E-01  0.7535939056E+00
 Determinant of Hessian:  0.1098460153E-06
 Ellipticity of electron density:    0.185045
 eta index:    0.134401
 
 ----------------   CP   155,     Type (3,-1)   ----------------
 Connected atoms:    62(N )   --    18(C )
 Position (Bohr):       -7.600610851341   -2.628219233891   -1.609417095638
 Position (Angstrom):   -4.022070051471   -1.390793723832   -0.851666849849
 Density of all electrons:  0.3339776483E+00
 Density of Alpha electrons:  0.1669888241E+00
 Density of Beta electrons:  0.1669888241E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1728657130E+00
 G(r) in X,Y,Z:  0.7265148128E-01  0.4125220312E-01  0.5896202864E-01
 Hamiltonian kinetic energy K(r):  0.4422666841E+00
 Potential energy density V(r): -0.6151323972E+00
 Energy density E(r) or H(r): -0.4422666841E+00
 Laplacian of electron density: -0.1077603884E+01
 Electron localization function (ELF):  0.8769915712E+00
 Localized orbital locator (LOL):  0.7275405811E+00
 Local information entropy:  0.5132543164E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3339776483E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2623955501E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1997172750E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1045557951E-01
 Wavefunction value for orbital         1 : -0.4532906212E-05
 Average local ionization energy (ALIE):  0.8068623578E+00
 Delta-g (under promolecular approximation):  0.3911359733E+00
 Delta-g (under Hirshfeld partition):  0.5582091297E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5834642293E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1874043455E-15  0.1144646444E-15 -0.3062871137E-16
 Norm of gradient is:  0.2217220365E-15
 
 Components of Laplacian in x/y/z are:
 -0.7112328033E+00  0.1645489979E+00 -0.5309200790E+00
 Total: -0.1077603884E+01
 
 Hessian matrix:
 -0.7112328033E+00  0.8411791434E-01  0.7466958120E-01
  0.8411791434E-01  0.1645489979E+00  0.4312915214E+00
  0.7466958120E-01  0.4312915214E+00 -0.5309200790E+00
 Eigenvalues of Hessian: -0.7614135348E+00 -0.6977215995E+00  0.3815312500E+00
 Eigenvectors(columns) of Hessian:
 -0.6136865783E+00 -0.7833786870E+00  0.9852216215E-01
 -0.2868712184E+00  0.3374860757E+00  0.8965534299E+00
  0.7355907066E+00 -0.5219396340E+00  0.4318394734E+00
 Determinant of Hessian:  0.2026902581E+00
 Ellipticity of electron density:    0.091286
 eta index:    1.995678
 
 ----------------   CP   156,     Type (3,-1)   ----------------
 Connected atoms:    19(C )   --    61(N )
 Position (Bohr):       -5.931735480005   -3.592701849149   -4.794336355907
 Position (Angstrom):   -3.138939237124   -1.901175944139   -2.537053540950
 Density of all electrons:  0.3687960217E+00
 Density of Alpha electrons:  0.1843980108E+00
 Density of Beta electrons:  0.1843980108E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2427848845E+00
 G(r) in X,Y,Z:  0.8958266312E-01  0.7033449648E-01  0.8286772486E-01
 Hamiltonian kinetic energy K(r):  0.5658278791E+00
 Potential energy density V(r): -0.8086127635E+00
 Energy density E(r) or H(r): -0.5658278791E+00
 Laplacian of electron density: -0.1292171978E+01
 Electron localization function (ELF):  0.8341766051E+00
 Localized orbital locator (LOL):  0.6916409450E+00
 Local information entropy:  0.5590143338E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3687960217E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2914534760E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8175678737E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1219665836E-01
 Wavefunction value for orbital         1 : -0.1097890090E-05
 Average local ionization energy (ALIE):  0.8733912403E+00
 Delta-g (under promolecular approximation):  0.4008837876E+00
 Delta-g (under Hirshfeld partition):  0.5792920803E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5703191315E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1799775606E-15 -0.2165151738E-15 -0.5022566564E-16
 Norm of gradient is:  0.2859953851E-15
 
 Components of Laplacian in x/y/z are:
 -0.4041194003E+00 -0.2863768534E+00 -0.6016757246E+00
 Total: -0.1292171978E+01
 
 Hessian matrix:
 -0.4041194003E+00  0.4528342131E+00 -0.2652585007E+00
  0.4528342131E+00 -0.2863768534E+00 -0.3967534878E+00
 -0.2652585007E+00 -0.3967534878E+00 -0.6016757246E+00
 Eigenvalues of Hessian: -0.8787081325E+00 -0.7614400287E+00  0.3479761828E+00
 Eigenvectors(columns) of Hessian:
  0.2155186546E+00 -0.7915567815E+00 -0.5718300195E+00
 -0.6518015254E+00  0.3194330934E+00 -0.6878352058E+00
 -0.7271220537E+00 -0.5209609971E+00  0.4470941271E+00
 Determinant of Hessian:  0.2328251382E+00
 Ellipticity of electron density:    0.154008
 eta index:    2.525196
 
 ----------------   CP   157,     Type (3,+1)   ----------------
 Position (Bohr):        1.790561522834   -3.074186336241   -1.311139147722
 Position (Angstrom):    0.947524352604   -1.626789351208   -0.693824957297
 Density of all electrons:  0.2219267057E-02
 Density of Alpha electrons:  0.1109633529E-02
 Density of Beta electrons:  0.1109633529E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1414774817E-02
 G(r) in X,Y,Z:  0.5565828506E-03  0.4832091994E-03  0.3749827667E-03
 Hamiltonian kinetic energy K(r): -0.4079813349E-03
 Potential energy density V(r): -0.1006793482E-02
 Energy density E(r) or H(r):  0.4079813349E-03
 Laplacian of electron density:  0.7291024606E-02
 Electron localization function (ELF):  0.5756643061E-02
 Localized orbital locator (LOL):  0.7117555288E-01
 Local information entropy:  0.5768005453E-04
 Reduced density gradient (RDG):  0.3169247158E-14
 Reduced density gradient with promolecular approximation:  0.3019844323E+00
 Sign(lambda2)*rho:  0.2219267057E-02
 Sign(lambda2)*rho with promolecular approximation:  0.4504281950E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2528430171E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1530250098E-03
 Wavefunction value for orbital         1 : -0.2912071058E-05
 Average local ionization energy (ALIE):  0.4944820003E+00
 Delta-g (under promolecular approximation):  0.5909949379E-02
 Delta-g (under Hirshfeld partition):  0.4274263526E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5476160822E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5644627561E-17  0.6166399856E-18  0.3794707604E-18
 Norm of gradient is:  0.5690875436E-17
 
 Components of Laplacian in x/y/z are:
  0.3159294460E-02  0.2482801738E-02  0.1648928408E-02
 Total:  0.7291024606E-02
 
 Hessian matrix:
  0.3159294460E-02  0.1279309928E-02 -0.4964748673E-03
  0.1279309928E-02  0.2482801738E-02 -0.2856876775E-02
 -0.4964748673E-03 -0.2856876775E-02  0.1648928408E-02
 Eigenvalues of Hessian: -0.8779824856E-03  0.2532577104E-02  0.5636429988E-02
 Eigenvectors(columns) of Hessian:
  0.1219940494E+00  0.8756987797E+00 -0.4671927859E+00
 -0.6693879008E+00 -0.2749533567E+00 -0.6901597568E+00
 -0.7328282815E+00  0.3969285817E+00  0.5526394945E+00
 Determinant of Hessian: -0.1253293091E-07
 Ellipticity of electron density:   -1.346676
 eta index:    0.155769
 
 ----------------   CP   158,     Type (3,-1)   ----------------
 Connected atoms:    15(C )   --    16(C )
 Position (Bohr):        9.171544678369   -3.698533473001   -0.591530771064
 Position (Angstrom):    4.853372432572   -1.957179627674   -0.313024603595
 Density of all electrons:  0.3085856330E+00
 Density of Alpha electrons:  0.1542928165E+00
 Density of Beta electrons:  0.1542928165E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1003795491E+00
 G(r) in X,Y,Z:  0.8809979593E-02  0.3174772213E-01  0.5982184735E-01
 Hamiltonian kinetic energy K(r):  0.3215503501E+00
 Potential energy density V(r): -0.4219298992E+00
 Energy density E(r) or H(r): -0.3215503501E+00
 Laplacian of electron density: -0.8846832042E+00
 Electron localization function (ELF):  0.9420070784E+00
 Localized orbital locator (LOL):  0.8012213776E+00
 Local information entropy:  0.4794018295E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3085856330E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2139390854E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5504595765E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7106258046E-02
 Wavefunction value for orbital         1 : -0.1077485045E-06
 Average local ionization energy (ALIE):  0.6710856311E+00
 Delta-g (under promolecular approximation):  0.3781889139E+00
 Delta-g (under Hirshfeld partition):  0.5591207230E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5489175462E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1165788386E-15  0.4857225733E-16  0.6418476861E-16
 Norm of gradient is:  0.1416671250E-15
 
 Components of Laplacian in x/y/z are:
  0.2404995071E+00 -0.5721235160E+00 -0.5530591952E+00
 Total: -0.8846832042E+00
 
 Hessian matrix:
  0.2404995071E+00 -0.2738632834E+00 -0.3343250620E-01
 -0.2738632834E+00 -0.5721235160E+00  0.1862692729E-01
 -0.3343250620E-01  0.1862692729E-01 -0.5530591952E+00
 Eigenvalues of Hessian: -0.6564367156E+00 -0.5540175489E+00  0.3257710603E+00
 Eigenvectors(columns) of Hessian:
 -0.2884348803E+00  0.6358553747E-01 -0.9553858902E+00
 -0.9542628607E+00  0.6288262380E-01  0.2922809749E+00
  0.7866201440E-01  0.9959933007E+00  0.4253977481E-01
 Determinant of Hessian:  0.1184755918E+00
 Ellipticity of electron density:    0.184866
 eta index:    2.015025
 
 ----------------   CP   159,     Type (3,-1)   ----------------
 Connected atoms:    63(N )   --    18(C )
 Position (Bohr):       -7.966107072777   -1.571209881382   -0.330656732718
 Position (Angstrom):   -4.215482322527   -0.831448462773   -0.174976007586
 Density of all electrons:  0.3382619953E+00
 Density of Alpha electrons:  0.1691309977E+00
 Density of Beta electrons:  0.1691309977E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2270660250E+00
 G(r) in X,Y,Z:  0.8887651824E-01  0.6972545666E-01  0.6846405013E-01
 Hamiltonian kinetic energy K(r):  0.5076483825E+00
 Potential energy density V(r): -0.7347144075E+00
 Energy density E(r) or H(r): -0.5076483825E+00
 Laplacian of electron density: -0.1122329430E+01
 Electron localization function (ELF):  0.8117328702E+00
 Localized orbital locator (LOL):  0.6749585929E+00
 Local information entropy:  0.5189249705E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3382619953E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2846325134E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1588222916E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1099049266E-01
 Wavefunction value for orbital         1 : -0.3713053374E-05
 Average local ionization energy (ALIE):  0.8852772061E+00
 Delta-g (under promolecular approximation):  0.3464791234E+00
 Delta-g (under Hirshfeld partition):  0.4965358404E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5855712174E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.9999732162E-16 -0.8785086916E-16 -0.1216034380E-15
 Norm of gradient is:  0.1802904204E-15
 
 Components of Laplacian in x/y/z are:
 -0.4409029714E+00 -0.7781465094E+00  0.9672005102E-01
 Total: -0.1122329430E+01
 
 Hessian matrix:
 -0.4409029714E+00 -0.1192178289E+00 -0.4382423856E+00
 -0.1192178289E+00 -0.7781465094E+00  0.1484416190E+00
 -0.4382423856E+00  0.1484416190E+00  0.9672005102E-01
 Eigenvalues of Hessian: -0.8162274999E+00 -0.6787857119E+00  0.3726837820E+00
 Eigenvectors(columns) of Hessian:
 -0.2791243311E+00 -0.8280502776E+00 -0.4862328101E+00
 -0.9600005285E+00  0.2289757777E+00  0.1611492428E+00
  0.2210413939E-01 -0.5117644293E+00  0.8588414149E+00
 Determinant of Hessian:  0.2064830510E+00
 Ellipticity of electron density:    0.202482
 eta index:    2.190134
 
 ----------------   CP   160,     Type (3,-1)   ----------------
 Connected atoms:    87(H )   --    65(N )
 Position (Bohr):        3.424171743685   -1.632872531761    3.888914896264
 Position (Angstrom):    1.811993652976   -0.864078932117    2.057925138244
 Density of all electrons:  0.3377934920E+00
 Density of Alpha electrons:  0.1688967460E+00
 Density of Beta electrons:  0.1688967460E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4910547439E-01
 G(r) in X,Y,Z:  0.1288748574E-01  0.1216828210E-01  0.2404970655E-01
 Hamiltonian kinetic energy K(r):  0.5138625861E+00
 Potential energy density V(r): -0.5629680604E+00
 Energy density E(r) or H(r): -0.5138625861E+00
 Laplacian of electron density: -0.1859028447E+01
 Electron localization function (ELF):  0.9892166590E+00
 Localized orbital locator (LOL):  0.9054804581E+00
 Local information entropy:  0.5183054336E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3377934920E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2141028341E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4811151921E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2723050099E-01
 Wavefunction value for orbital         1 : -0.1236973937E-06
 Average local ionization energy (ALIE):  0.6935470552E+00
 Delta-g (under promolecular approximation):  0.5057860503E+00
 Delta-g (under Hirshfeld partition):  0.7470401784E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5645942556E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.6227597986E-16 -0.1530148079E-15  0.4737455274E-16
 Norm of gradient is:  0.1718609244E-15
 
 Components of Laplacian in x/y/z are:
 -0.8728163818E+00 -0.3957394125E-01 -0.9466381236E+00
 Total: -0.1859028447E+01
 
 Hessian matrix:
 -0.8728163818E+00 -0.7886485874E+00 -0.4226926064E+00
 -0.7886485874E+00 -0.3957394125E-01  0.6791846898E+00
 -0.4226926064E+00  0.6791846898E+00 -0.9466381236E+00
 Eigenvalues of Hessian: -0.1350957239E+01 -0.1309781688E+01  0.8017104798E+00
 Eigenvectors(columns) of Hessian:
 -0.8818236191E+00 -0.1664049011E-01 -0.4712856872E+00
 -0.4065808273E+00 -0.4794785099E+00  0.7776839907E+00
 -0.2389124018E+00  0.8773958358E+00  0.4160497706E+00
 Determinant of Hessian:  0.1418593866E+01
 Ellipticity of electron density:    0.031437
 eta index:    1.685094
 
 ----------------   CP   161,     Type (3,+1)   ----------------
 Position (Bohr):       -3.413751720767   -1.922611612178   -0.661081941162
 Position (Angstrom):   -1.806479614311   -1.017402250582   -0.349829497803
 Density of all electrons:  0.2369309289E-02
 Density of Alpha electrons:  0.1184654645E-02
 Density of Beta electrons:  0.1184654645E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1432853005E-02
 G(r) in X,Y,Z:  0.5640977127E-03  0.4956004644E-03  0.3731548283E-03
 Hamiltonian kinetic energy K(r): -0.4332548020E-03
 Potential energy density V(r): -0.9995982034E-03
 Energy density E(r) or H(r):  0.4332548020E-03
 Laplacian of electron density:  0.7464431229E-02
 Electron localization function (ELF):  0.6972578800E-02
 Localized orbital locator (LOL):  0.7781355860E-01
 Local information entropy:  0.6125134254E-04
 Reduced density gradient (RDG):  0.9313031264E-15
 Reduced density gradient with promolecular approximation:  0.5874713195E+00
 Sign(lambda2)*rho:  0.2369309289E-02
 Sign(lambda2)*rho with promolecular approximation:  0.4551454434E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1470646099E-03
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1494977910E-03
 Wavefunction value for orbital         1 :  0.4613092646E-05
 Average local ionization energy (ALIE):  0.4841264354E+00
 Delta-g (under promolecular approximation):  0.4463921104E-02
 Delta-g (under Hirshfeld partition):  0.4242823950E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5625153071E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1769451827E-17  0.2744386749E-18 -0.1084202172E-18
 Norm of gradient is:  0.1793887203E-17
 
 Components of Laplacian in x/y/z are:
  0.3434505520E-02  0.2485445337E-02  0.1544480373E-02
 Total:  0.7464431229E-02
 
 Hessian matrix:
  0.3434505520E-02 -0.3001649680E-02  0.2127342511E-02
 -0.3001649680E-02  0.2485445337E-02 -0.4526559604E-03
  0.2127342511E-02 -0.4526559604E-03  0.1544480373E-02
 Eigenvalues of Hessian: -0.7090587503E-03  0.1447263836E-02  0.6726226144E-02
 Eigenvectors(columns) of Hessian:
  0.6604781599E+00  0.9556982775E-01  0.7447382146E+00
  0.5478498667E+00  0.6169256061E+00 -0.5650339106E+00
 -0.5134482680E+00  0.7811972891E+00  0.3551079717E+00
 Determinant of Hessian: -0.6902420221E-08
 Ellipticity of electron density:   -1.489931
 eta index:    0.105417
 
 ----------------   CP   162,     Type (3,+1)   ----------------
 Position (Bohr):        4.269654939219   -2.242639481511    1.428062746682
 Position (Angstrom):    2.259404092254   -1.186753705887    0.755698261284
 Density of all electrons:  0.3590776843E-02
 Density of Alpha electrons:  0.1795388421E-02
 Density of Beta electrons:  0.1795388421E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2680650274E-02
 G(r) in X,Y,Z:  0.3771443400E-03  0.9583409648E-03  0.1345164969E-02
 Hamiltonian kinetic energy K(r): -0.7716970834E-03
 Potential energy density V(r): -0.1908953190E-02
 Energy density E(r) or H(r):  0.7716970834E-03
 Laplacian of electron density:  0.1380938943E-01
 Electron localization function (ELF):  0.8008637092E-02
 Localized orbital locator (LOL):  0.8272591509E-01
 Local information entropy:  0.8966569702E-04
 Reduced density gradient (RDG):  0.1665028988E-14
 Reduced density gradient with promolecular approximation:  0.2174934336E+00
 Sign(lambda2)*rho:  0.3590776843E-02
 Sign(lambda2)*rho with promolecular approximation:  0.8551896927E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5449981310E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2184817146E-03
 Wavefunction value for orbital         1 : -0.1424664568E-05
 Average local ionization energy (ALIE):  0.5590993121E+00
 Delta-g (under promolecular approximation):  0.1127058158E-01
 Delta-g (under Hirshfeld partition):  0.6943545270E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5483225575E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1002887010E-17 -0.4153849573E-17 -0.3571090906E-17
 Norm of gradient is:  0.5568926188E-17
 
 Components of Laplacian in x/y/z are:
  0.1904517639E-03  0.4643506096E-02  0.8975431569E-02
 Total:  0.1380938943E-01
 
 Hessian matrix:
  0.1904517639E-03 -0.6843153005E-03 -0.3936646397E-02
 -0.6843153005E-03  0.4643506096E-02  0.2287296859E-02
 -0.3936646397E-02  0.2287296859E-02  0.8975431569E-02
 Eigenvalues of Hessian: -0.1321242790E-02  0.3801176578E-02  0.1132945564E-01
 Eigenvectors(columns) of Hessian:
 -0.9311437408E+00  0.1504860052E+00 -0.3321525195E+00
  0.3245114963E-01  0.9414572019E+00  0.3355670722E+00
 -0.3632055297E+00 -0.3016824478E+00  0.8815154246E+00
 Determinant of Hessian: -0.5689966615E-07
 Ellipticity of electron density:   -1.347588
 eta index:    0.116620
 
 ----------------   CP   163,     Type (3,-1)   ----------------
 Connected atoms:    89(H )   --    36(O )
 Position (Bohr):       -0.367886077600   -2.542128394619   -2.145759528700
 Position (Angstrom):   -0.194676928475   -1.345236413622   -1.135487042666
 Density of all electrons:  0.4315801357E-02
 Density of Alpha electrons:  0.2157900678E-02
 Density of Beta electrons:  0.2157900678E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3107662088E-02
 G(r) in X,Y,Z:  0.6954570873E-03  0.1526365979E-02  0.8858390223E-03
 Hamiltonian kinetic energy K(r): -0.9270931628E-03
 Potential energy density V(r): -0.2180568926E-02
 Energy density E(r) or H(r):  0.9270931628E-03
 Laplacian of electron density:  0.1613902100E-01
 Electron localization function (ELF):  0.1097883276E-01
 Localized orbital locator (LOL):  0.9559466574E-01
 Local information entropy:  0.1060887178E-03
 Reduced density gradient (RDG):  0.3824924179E-15
 Reduced density gradient with promolecular approximation:  0.6570066192E+00
 Sign(lambda2)*rho: -0.4315801357E-02
 Sign(lambda2)*rho with promolecular approximation: -0.7124682149E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8267039622E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.3837238082E-03
 Wavefunction value for orbital         1 :  0.1647496821E-05
 Average local ionization energy (ALIE):  0.5434381138E+00
 Delta-g (under promolecular approximation):  0.9041838004E-02
 Delta-g (under Hirshfeld partition):  0.7890268821E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5548451707E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1382357770E-17 -0.1084202172E-18 -0.4336808690E-18
 Norm of gradient is:  0.1452841025E-17
 
 Components of Laplacian in x/y/z are:
  0.2090358605E-02  0.1007947581E-01  0.3969186592E-02
 Total:  0.1613902100E-01
 
 Hessian matrix:
  0.2090358605E-02  0.7596967811E-02 -0.5459254311E-02
  0.7596967811E-02  0.1007947581E-01 -0.9832268991E-02
 -0.5459254311E-02 -0.9832268991E-02  0.3969186592E-02
 Eigenvalues of Hessian: -0.3282227880E-02 -0.2346244595E-02  0.2176749348E-01
 Eigenvectors(columns) of Hessian:
 -0.9636772496E-01  0.8979789836E+00 -0.4293565029E+00
  0.6248891982E+00 -0.2811766374E+00 -0.7283221736E+00
  0.7747430229E+00  0.3384869918E+00  0.5340410142E+00
 Determinant of Hessian:  0.1676294957E-06
 Ellipticity of electron density:    0.398928
 eta index:    0.150786
 
 ----------------   CP   164,     Type (3,+1)   ----------------
 Position (Bohr):       -6.312199118407   -2.105642030093   -3.272059117334
 Position (Angstrom):   -3.340271924143   -1.114257776645   -1.731499117620
 Density of all electrons:  0.3231881721E-01
 Density of Alpha electrons:  0.1615940860E-01
 Density of Beta electrons:  0.1615940860E-01
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4834500790E-01
 G(r) in X,Y,Z:  0.1084598610E-01  0.2067497903E-01  0.1682404278E-01
 Hamiltonian kinetic energy K(r): -0.3799292912E-02
 Potential energy density V(r): -0.4454571499E-01
 Energy density E(r) or H(r):  0.3799292912E-02
 Laplacian of electron density:  0.2085772032E+00
 Electron localization function (ELF):  0.3652683771E-01
 Localized orbital locator (LOL):  0.1630043677E+00
 Local information entropy:  0.6565844773E-03
 Reduced density gradient (RDG):  0.5820576775E-15
 Reduced density gradient with promolecular approximation:  0.1019705424E-01
 Sign(lambda2)*rho:  0.3231881721E-01
 Sign(lambda2)*rho with promolecular approximation:  0.6279448183E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6350430425E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2238406614E-02
 Wavefunction value for orbital         1 : -0.4337813843E-05
 Average local ionization energy (ALIE):  0.7994561346E+00
 Delta-g (under promolecular approximation):  0.1119488800E+00
 Delta-g (under Hirshfeld partition):  0.6979425140E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5630126804E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2383889527E-16  0.1421660099E-16 -0.2120970500E-16
 Norm of gradient is:  0.3493216651E-16
 
 Components of Laplacian in x/y/z are:
  0.2443567246E-01  0.1082728572E+00  0.7586867356E-01
 Total:  0.2085772032E+00
 
 Hessian matrix:
  0.2443567246E-01  0.3757709059E-01 -0.5669600147E-01
  0.3757709059E-01  0.1082728572E+00  0.2749373470E-01
 -0.5669600147E-01  0.2749373470E-01  0.7586867356E-01
 Eigenvalues of Hessian: -0.2796688393E-01  0.1118599582E+00  0.1246841290E+00
 Eigenvectors(columns) of Hessian:
 -0.7920549058E+00 -0.5912279337E+00 -0.1519820931E+00
  0.3229956427E+00 -0.1946267145E+00 -0.9261718290E+00
 -0.5179988813E+00  0.7826684946E+00 -0.3451190905E+00
 Determinant of Hessian: -0.3900586455E-03
 Ellipticity of electron density:   -1.250017
 eta index:    0.224302
 
 ----------------   CP   165,     Type (3,+3)   ----------------
 Position (Bohr):        1.704700743890   -2.100576965065   -0.379258862397
 Position (Angstrom):    0.902088785076   -1.111577459660   -0.200695147014
 Density of all electrons:  0.1965536867E-02
 Density of Alpha electrons:  0.9827684337E-03
 Density of Beta electrons:  0.9827684337E-03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1245947741E-02
 G(r) in X,Y,Z:  0.4989623988E-03  0.3271167473E-03  0.4198685951E-03
 Hamiltonian kinetic energy K(r): -0.3067934065E-03
 Potential energy density V(r): -0.9391543348E-03
 Energy density E(r) or H(r):  0.3067934065E-03
 Laplacian of electron density:  0.6210964591E-02
 Electron localization function (ELF):  0.4946648509E-02
 Localized orbital locator (LOL):  0.6635674134E-01
 Local information entropy:  0.5159104874E-04
 Reduced density gradient (RDG):  0.1100433728E-14
 Reduced density gradient with promolecular approximation:  0.7173637577E-01
 Sign(lambda2)*rho:  0.1965536867E-02
 Sign(lambda2)*rho with promolecular approximation:  0.3734347901E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2600534880E-03
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1809313572E-03
 Wavefunction value for orbital         1 : -0.6087969414E-07
 Average local ionization energy (ALIE):  0.4894270100E+00
 Delta-g (under promolecular approximation):  0.5213210430E-02
 Delta-g (under Hirshfeld partition):  0.3970755569E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5670083236E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4167402100E-18 -0.1131636018E-17 -0.1185846126E-17
 Norm of gradient is:  0.1691302313E-17
 
 Components of Laplacian in x/y/z are:
  0.2890047937E-02  0.1194073692E-02  0.2126842961E-02
 Total:  0.6210964591E-02
 
 Hessian matrix:
  0.2890047937E-02  0.9041822935E-03 -0.1698817008E-02
  0.9041822935E-03  0.1194073692E-02 -0.9685424323E-03
 -0.1698817008E-02 -0.9685424323E-03  0.2126842961E-02
 Eigenvalues of Hessian:  0.5557853774E-03  0.9190004328E-03  0.4736178781E-02
 Eigenvectors(columns) of Hessian:
 -0.2064458344E+00 -0.6610312274E+00 -0.7213999126E+00
 -0.7173206277E+00  0.6036790829E+00 -0.3478831439E+00
 -0.6654556593E+00 -0.4456560123E+00  0.5987983669E+00
 Determinant of Hessian:  0.2419083839E-08
 Ellipticity of electron density:   -0.395228
 eta index:    0.117349
 
 ----------------   CP   166,     Type (3,-1)   ----------------
 Connected atoms:    68(N )   --    74(C )
 Position (Bohr):       -0.209808639749   -0.834815823559    3.381085210508
 Position (Angstrom):   -0.111025950806   -0.441765509128    1.789193241522
 Density of all electrons:  0.3534920981E+00
 Density of Alpha electrons:  0.1767460490E+00
 Density of Beta electrons:  0.1767460490E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2117228945E+00
 G(r) in X,Y,Z:  0.6853770598E-01  0.5953299108E-01  0.8365219745E-01
 Hamiltonian kinetic energy K(r):  0.5162994262E+00
 Potential energy density V(r): -0.7280223207E+00
 Energy density E(r) or H(r): -0.5162994262E+00
 Laplacian of electron density: -0.1218306127E+01
 Electron localization function (ELF):  0.8517040845E+00
 Localized orbital locator (LOL):  0.7055902020E+00
 Local information entropy:  0.5389910558E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3534920981E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2821273210E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.9170021100E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2778776151E-01
 Wavefunction value for orbital         1 :  0.3160053651E-06
 Average local ionization energy (ALIE):  0.8508824935E+00
 Delta-g (under promolecular approximation):  0.3962852311E+00
 Delta-g (under Hirshfeld partition):  0.5659651397E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6213277582E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1605974468E-17 -0.6407634839E-16  0.1001667282E-15
 Norm of gradient is:  0.1189190103E-15
 
 Components of Laplacian in x/y/z are:
 -0.4528652424E+00 -0.3172787814E+00 -0.4481621029E+00
 Total: -0.1218306127E+01
 
 Hessian matrix:
 -0.4528652424E+00  0.4401231148E+00  0.3135490316E+00
  0.4401231148E+00 -0.3172787814E+00  0.3671992768E+00
  0.3135490316E+00  0.3671992768E+00 -0.4481621029E+00
 Eigenvalues of Hessian: -0.8303953438E+00 -0.7396299874E+00  0.3517192045E+00
 Eigenvectors(columns) of Hessian:
 -0.7558268617E+00 -0.3441690379E+00  0.5570219282E+00
  0.6547103789E+00 -0.3856235970E+00  0.6501144216E+00
 -0.8948455433E-02  0.8560619807E+00  0.5167957143E+00
 Determinant of Hessian:  0.2160207643E+00
 Ellipticity of electron density:    0.122717
 eta index:    2.360961
 
 ----------------   CP   167,     Type (3,+1)   ----------------
 Position (Bohr):       -1.993379442399   -2.174743340058   -2.906895410808
 Position (Angstrom):   -1.054850973600   -1.150824615122   -1.538262805878
 Density of all electrons:  0.2286400106E-02
 Density of Alpha electrons:  0.1143200053E-02
 Density of Beta electrons:  0.1143200053E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1576646484E-02
 G(r) in X,Y,Z:  0.6333238335E-03  0.5024187906E-03  0.4409038602E-03
 Hamiltonian kinetic energy K(r): -0.4140102311E-03
 Potential energy density V(r): -0.1162636253E-02
 Energy density E(r) or H(r):  0.4140102311E-03
 Laplacian of electron density:  0.7962626862E-02
 Electron localization function (ELF):  0.5129998872E-02
 Localized orbital locator (LOL):  0.6739375190E-01
 Local information entropy:  0.5928052099E-04
 Reduced density gradient (RDG):  0.5482954014E-15
 Reduced density gradient with promolecular approximation:  0.5895570741E+00
 Sign(lambda2)*rho:  0.2286400106E-02
 Sign(lambda2)*rho with promolecular approximation:  0.5200329006E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2596246434E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1529942292E-03
 Wavefunction value for orbital         1 :  0.3965976733E-05
 Average local ionization energy (ALIE):  0.5379754583E+00
 Delta-g (under promolecular approximation):  0.5663177660E-02
 Delta-g (under Hirshfeld partition):  0.4119577957E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5507785431E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1084202172E-17 -0.2168404345E-18  0.4590918574E-18
 Norm of gradient is:  0.1197196499E-17
 
 Components of Laplacian in x/y/z are:
  0.3719037779E-02  0.2382279383E-02  0.1861309700E-02
 Total:  0.7962626862E-02
 
 Hessian matrix:
  0.3719037779E-02  0.3686952062E-03  0.1062434598E-02
  0.3686952062E-03  0.2382279383E-02 -0.2742038092E-02
  0.1062434598E-02 -0.2742038092E-02  0.1861309700E-02
 Eigenvalues of Hessian: -0.8674623528E-03  0.3782512076E-02  0.5047577138E-02
 Eigenvectors(columns) of Hessian:
 -0.2214659399E+00 -0.9060054578E+00  0.3607034071E+00
  0.6434217122E+00 -0.4137083335E+00 -0.6440915425E+00
  0.7327764583E+00  0.8944006490E-01  0.6745658878E+00
 Determinant of Hessian: -0.1656204360E-07
 Ellipticity of electron density:   -1.229335
 eta index:    0.171857
 
 ----------------   CP   168,     Type (3,-1)   ----------------
 Connected atoms:    15(C )   --    29(S )
 Position (Bohr):       11.622671959555   -3.088543164693   -0.855842213560
 Position (Angstrom):    6.150453130798   -1.634386657646   -0.452892195545
 Density of all electrons:  0.1990532658E+00
 Density of Alpha electrons:  0.9952663289E-01
 Density of Beta electrons:  0.9952663289E-01
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4098600621E-01
 G(r) in X,Y,Z:  0.1228459348E-01  0.1263444775E-01  0.1606696499E-01
 Hamiltonian kinetic energy K(r):  0.1426636710E+00
 Potential energy density V(r): -0.1836496772E+00
 Energy density E(r) or H(r): -0.1426636710E+00
 Laplacian of electron density: -0.4067106592E+00
 Electron localization function (ELF):  0.9576062465E+00
 Localized orbital locator (LOL):  0.8262043247E+00
 Local information entropy:  0.3277277832E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1990532658E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1283477755E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1537519568E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2684454945E-02
 Wavefunction value for orbital         1 : -0.1329651190E-06
 Average local ionization energy (ALIE):  0.6181758294E+00
 Delta-g (under promolecular approximation):  0.2570906176E+00
 Delta-g (under Hirshfeld partition):  0.3704728762E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5274418906E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.5812340084E-17  0.1704955562E-15 -0.1879057890E-16
 Norm of gradient is:  0.1716263495E-15
 
 Components of Laplacian in x/y/z are:
  0.3589522436E-02 -0.9120977771E-01 -0.3190904039E+00
 Total: -0.4067106592E+00
 
 Hessian matrix:
  0.3589522436E-02  0.2939732000E+00 -0.5664678959E-01
  0.2939732000E+00 -0.9120977771E-01 -0.4771347761E-01
 -0.5664678959E-01 -0.4771347761E-01 -0.3190904039E+00
 Eigenvalues of Hessian: -0.3415924311E+00 -0.3284953972E+00  0.2633771691E+00
 Eigenvectors(columns) of Hessian:
  0.6509646907E+00  0.7611196778E-01 -0.7552826887E+00
 -0.7584983299E+00  0.1050853517E+00 -0.6431464471E+00
  0.3041800533E-01  0.9915462860E+00  0.1261376539E+00
 Determinant of Hessian:  0.2955395810E-01
 Ellipticity of electron density:    0.039870
 eta index:    1.296971
 
 ----------------   CP   169,     Type (3,-1)   ----------------
 Connected atoms:    18(C )   --    60(N )
 Position (Bohr):       -6.988136424213   -0.988051399472   -1.553831589952
 Position (Angstrom):   -3.697962542375   -0.522854283801   -0.822252266984
 Density of all electrons:  0.3497221755E+00
 Density of Alpha electrons:  0.1748610878E+00
 Density of Beta electrons:  0.1748610878E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2021108120E+00
 G(r) in X,Y,Z:  0.7298636558E-01  0.5975416506E-01  0.6937028133E-01
 Hamiltonian kinetic energy K(r):  0.5000193321E+00
 Potential energy density V(r): -0.7021301441E+00
 Energy density E(r) or H(r): -0.5000193321E+00
 Laplacian of electron density: -0.1191634081E+01
 Electron localization function (ELF):  0.8587818517E+00
 Localized orbital locator (LOL):  0.7114945991E+00
 Local information entropy:  0.5340372621E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3497221755E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2765946217E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1640309754E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1312185157E-01
 Wavefunction value for orbital         1 :  0.1468887631E-05
 Average local ionization energy (ALIE):  0.8341701069E+00
 Delta-g (under promolecular approximation):  0.3908276877E+00
 Delta-g (under Hirshfeld partition):  0.5626391330E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5983526217E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1541193388E-15  0.2320192649E-15  0.2538218930E-16
 Norm of gradient is:  0.2796962020E-15
 
 Components of Laplacian in x/y/z are:
 -0.4240341240E+00 -0.1443804242E+00 -0.6232195323E+00
 Total: -0.1191634081E+01
 
 Hessian matrix:
 -0.4240341240E+00  0.4523613905E+00 -0.2082987346E+00
  0.4523613905E+00 -0.1443804242E+00 -0.3488130209E+00
 -0.2082987346E+00 -0.3488130209E+00 -0.6232195323E+00
 Eigenvalues of Hessian: -0.8138674657E+00 -0.7341807489E+00  0.3564141340E+00
 Eigenvectors(columns) of Hessian:
  0.2529275245E+00 -0.8043447060E+00 -0.5376404573E+00
 -0.5759300823E+00  0.3213447033E+00 -0.7516928375E+00
 -0.7773880676E+00 -0.4997671214E+00  0.3819693924E+00
 Determinant of Hessian:  0.2129666496E+00
 Ellipticity of electron density:    0.108538
 eta index:    2.283488
 
 ----------------   CP   170,     Type (3,-1)   ----------------
 Connected atoms:    63(N )   --    26(C )
 Position (Bohr):       -8.664707100877    0.220239625243    1.809033569172
 Position (Angstrom):   -4.585165536934    0.116545790616    0.957299338564
 Density of all electrons:  0.2490075234E+00
 Density of Alpha electrons:  0.1245037617E+00
 Density of Beta electrons:  0.1245037617E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1402046652E+00
 G(r) in X,Y,Z:  0.6033788268E-01  0.2875012927E-01  0.5111665329E-01
 Hamiltonian kinetic energy K(r):  0.2874005343E+00
 Potential energy density V(r): -0.4276051995E+00
 Energy density E(r) or H(r): -0.2874005343E+00
 Laplacian of electron density: -0.5887834762E+00
 Electron localization function (ELF):  0.8028819111E+00
 Localized orbital locator (LOL):  0.6686916769E+00
 Local information entropy:  0.3981615081E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2490075234E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2321594346E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1109434968E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.5291667473E-02
 Wavefunction value for orbital         1 : -0.1538190569E-05
 Average local ionization energy (ALIE):  0.7552946712E+00
 Delta-g (under promolecular approximation):  0.2620668282E+00
 Delta-g (under Hirshfeld partition):  0.3560325064E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5388612921E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2263572732E-15  0.7090533977E-16  0.5493178070E-16
 Norm of gradient is:  0.2434803542E-15
 
 Components of Laplacian in x/y/z are:
 -0.4512551427E+00  0.1625335657E+00 -0.3000618992E+00
 Total: -0.5887834762E+00
 
 Hessian matrix:
 -0.4512551427E+00  0.2859632751E-01  0.2048438520E-01
  0.2859632751E-01  0.1625335657E+00  0.3179478763E+00
  0.2048438520E-01  0.3179478763E+00 -0.3000618992E+00
 Eigenvalues of Hessian: -0.4643533289E+00 -0.4504009095E+00  0.3259707622E+00
 Eigenvectors(columns) of Hessian:
 -0.4152379720E+00 -0.9086138098E+00  0.4470314555E-01
 -0.3963559630E+00  0.2249284522E+00  0.8901174878E+00
  0.8188280511E+00 -0.3518922222E+00  0.4535333359E+00
 Determinant of Hessian:  0.6817520777E-01
 Ellipticity of electron density:    0.030978
 eta index:    1.424524
 
 ----------------   CP   171,     Type (3,-1)   ----------------
 Connected atoms:    68(N )   --    60(N )
 Position (Bohr):       -3.648866863930   -0.811545517247    0.171200268512
 Position (Angstrom):   -1.930897190011   -0.429451393338    0.090595280597
 Density of all electrons:  0.2954981190E-02
 Density of Alpha electrons:  0.1477490595E-02
 Density of Beta electrons:  0.1477490595E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1543692045E-02
 G(r) in X,Y,Z:  0.7209640340E-03  0.1873807102E-03  0.6353473010E-03
 Hamiltonian kinetic energy K(r): -0.4485226204E-03
 Potential energy density V(r): -0.1095169425E-02
 Energy density E(r) or H(r):  0.4485226204E-03
 Laplacian of electron density:  0.7968858662E-02
 Electron localization function (ELF):  0.1248721969E-01
 Localized orbital locator (LOL):  0.1016718653E+00
 Local information entropy:  0.7500920483E-04
 Reduced density gradient (RDG):  0.8421468292E-15
 Reduced density gradient with promolecular approximation:  0.5787608005E+00
 Sign(lambda2)*rho: -0.2954981190E-02
 Sign(lambda2)*rho with promolecular approximation: -0.2950196000E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2449520402E-03
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1694684955E-03
 Wavefunction value for orbital         1 : -0.2296344054E-05
 Average local ionization energy (ALIE):  0.4228438036E+00
 Delta-g (under promolecular approximation):  0.3468940765E-02
 Delta-g (under Hirshfeld partition):  0.5971798649E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5604916358E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.7309894335E-18 -0.8235277830E-18  0.1878719077E-17
 Norm of gradient is:  0.2177642976E-17
 
 Components of Laplacian in x/y/z are:
  0.4707702450E-02 -0.4828869420E-03  0.3744043154E-02
 Total:  0.7968858662E-02
 
 Hessian matrix:
  0.4707702450E-02 -0.2152452113E-02  0.5537198384E-02
 -0.2152452113E-02 -0.4828869420E-03 -0.2055264226E-02
  0.5537198384E-02 -0.2055264226E-02  0.3744043154E-02
 Eigenvalues of Hessian: -0.1370942782E-02 -0.1244214843E-02  0.1058401629E-01
 Eigenvectors(columns) of Hessian:
 -0.4583485592E+00  0.5333571690E+00  0.7109477678E+00
  0.5337526075E+00  0.8047922058E+00 -0.2596491082E+00
  0.7106509356E+00 -0.2604604303E+00  0.6535561277E+00
 Determinant of Hessian:  0.1805365782E-07
 Ellipticity of electron density:    0.101854
 eta index:    0.129530
 
 ----------------   CP   172,     Type (3,-1)   ----------------
 Connected atoms:    65(N )   --    74(C )
 Position (Bohr):        1.253828872869   -0.286847036445    4.077067232363
 Position (Angstrom):    0.663497665894   -0.151792914702    2.157491066686
 Density of all electrons:  0.3371338119E+00
 Density of Alpha electrons:  0.1685669060E+00
 Density of Beta electrons:  0.1685669060E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1965916194E+00
 G(r) in X,Y,Z:  0.4616830219E-01  0.6836565429E-01  0.8205766288E-01
 Hamiltonian kinetic energy K(r):  0.4834564892E+00
 Potential energy density V(r): -0.6800481085E+00
 Energy density E(r) or H(r): -0.4834564892E+00
 Laplacian of electron density: -0.1147459479E+01
 Electron localization function (ELF):  0.8504817222E+00
 Localized orbital locator (LOL):  0.7045881584E+00
 Local information entropy:  0.5174328563E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3371338119E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2755160645E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2340351206E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2135880134E-01
 Wavefunction value for orbital         1 : -0.3326026663E-06
 Average local ionization energy (ALIE):  0.8589872758E+00
 Delta-g (under promolecular approximation):  0.3652174137E+00
 Delta-g (under Hirshfeld partition):  0.5220237556E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6093645753E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4209923154E-16  0.6388661301E-16 -0.3610189946E-15
 Norm of gradient is:  0.3690373411E-15
 
 Components of Laplacian in x/y/z are:
  0.2628606223E+00 -0.7631731815E+00 -0.6471469200E+00
 Total: -0.1147459479E+01
 
 Hessian matrix:
  0.2628606223E+00 -0.1419942667E+00  0.2655515272E+00
 -0.1419942667E+00 -0.7631731815E+00 -0.7369672250E-01
  0.2655515272E+00 -0.7369672250E-01 -0.6471469200E+00
 Eigenvalues of Hessian: -0.7991895198E+00 -0.7047952577E+00  0.3565252983E+00
 Eigenvectors(columns) of Hessian:
 -0.2026717830E-01 -0.2963202055E+00 -0.9548735923E+00
 -0.9131146262E+00 -0.3834971961E+00  0.1383892339E+00
 -0.4071988715E+00  0.8747138026E+00 -0.2628019077E+00
 Determinant of Hessian:  0.2008182163E+00
 Ellipticity of electron density:    0.133931
 eta index:    2.241607
 
 ----------------   CP   173,     Type (3,-1)   ----------------
 Connected atoms:    16(C )   --    58(N )
 Position (Bohr):        7.619969504054   -2.297668126060   -0.573770083689
 Position (Angstrom):    4.032314209321   -1.215873610529   -0.303626052586
 Density of all electrons:  0.2959982598E+00
 Density of Alpha electrons:  0.1479991299E+00
 Density of Beta electrons:  0.1479991299E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1363245157E+00
 G(r) in X,Y,Z:  0.5027384616E-01  0.2653009483E-01  0.5952057466E-01
 Hamiltonian kinetic energy K(r):  0.3479412489E+00
 Potential energy density V(r): -0.4842657645E+00
 Energy density E(r) or H(r): -0.3479412489E+00
 Laplacian of electron density: -0.8464669328E+00
 Electron localization function (ELF):  0.8846035109E+00
 Localized orbital locator (LOL):  0.7346717679E+00
 Local information entropy:  0.4624584430E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2959982598E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2371915535E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1588359368E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8441593475E-02
 Wavefunction value for orbital         1 : -0.2361730572E-06
 Average local ionization energy (ALIE):  0.7448019049E+00
 Delta-g (under promolecular approximation):  0.3350400787E+00
 Delta-g (under Hirshfeld partition):  0.4876796281E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5820112387E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1515714637E-15  0.8977193988E-16  0.2908372328E-16
 Norm of gradient is:  0.1785462762E-15
 
 Components of Laplacian in x/y/z are:
 -0.5836776716E+00  0.3468872805E+00 -0.6096765417E+00
 Total: -0.8464669328E+00
 
 Hessian matrix:
 -0.5836776716E+00 -0.2365192284E+00 -0.6164003639E-02
 -0.2365192284E+00  0.3468872805E+00 -0.6234072798E-04
 -0.6164003639E-02 -0.6234072798E-04 -0.6096765417E+00
 Eigenvalues of Hessian: -0.6414780782E+00 -0.6085429643E+00  0.4035541097E+00
 Eigenvectors(columns) of Hessian:
  0.9556268957E+00  0.1802541145E+00  0.2329928977E+00
  0.2286965130E+00  0.4455825810E-01 -0.9724774890E+00
  0.1856748264E+00 -0.9826103072E+00 -0.1357582415E-02
 Determinant of Hessian:  0.1575341955E+00
 Ellipticity of electron density:    0.054121
 eta index:    1.589571
 
 ----------------   CP   174,     Type (3,+1)   ----------------
 Position (Bohr):       -4.637153450772   -0.125061715469    1.710004705637
 Position (Angstrom):   -2.453875929609   -0.066179809783    0.904895520760
 Density of all electrons:  0.1719187530E-02
 Density of Alpha electrons:  0.8595937649E-03
 Density of Beta electrons:  0.8595937649E-03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1057934720E-02
 G(r) in X,Y,Z:  0.5335563143E-03  0.2372053642E-03  0.2871730410E-03
 Hamiltonian kinetic energy K(r): -0.3298602210E-03
 Potential energy density V(r): -0.7280744985E-03
 Energy density E(r) or H(r):  0.3298602210E-03
 Laplacian of electron density:  0.5551179762E-02
 Electron localization function (ELF):  0.4380784351E-02
 Localized orbital locator (LOL):  0.6275770011E-01
 Local information entropy:  0.4561267658E-04
 Reduced density gradient (RDG):  0.2565531781E-14
 Reduced density gradient with promolecular approximation:  0.8881824789E+00
 Sign(lambda2)*rho:  0.1719187530E-02
 Sign(lambda2)*rho with promolecular approximation:  0.2959788596E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3972748161E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.8935083788E-04
 Wavefunction value for orbital         1 : -0.3054159629E-05
 Average local ionization energy (ALIE):  0.4639609511E+00
 Delta-g (under promolecular approximation):  0.2646228078E-02
 Delta-g (under Hirshfeld partition):  0.2948653797E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5367615394E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2419364325E-17  0.1403904171E-17  0.3729062550E-18
 Norm of gradient is:  0.2821937231E-17
 
 Components of Laplacian in x/y/z are:
  0.3622194647E-02  0.6698564795E-03  0.1259128635E-02
 Total:  0.5551179762E-02
 
 Hessian matrix:
  0.3622194647E-02 -0.1946176117E-02  0.2020795234E-03
 -0.1946176117E-02  0.6698564795E-03  0.2983712162E-03
  0.2020795234E-03  0.2983712162E-03  0.1259128635E-02
 Eigenvalues of Hessian: -0.3747300502E-03  0.1336500709E-02  0.4589409103E-02
 Eigenvectors(columns) of Hessian:
  0.4363854203E+00  0.8201834109E-01 -0.8960138150E+00
  0.8740410537E+00  0.1977534460E+00  0.4437857715E+00
 -0.2135883924E+00  0.9768144994E+00 -0.1460932339E-01
 Determinant of Hessian: -0.2298499890E-08
 Ellipticity of electron density:   -1.280381
 eta index:    0.081651
 
 ----------------   CP   175,     Type (3,-1)   ----------------
 Connected atoms:    56(H )   --    26(C )
 Position (Bohr):       -9.560784560032    1.182908353145    3.222654846107
 Position (Angstrom):   -5.059349307522    0.625968143071    1.705355503166
 Density of all electrons:  0.2857918188E+00
 Density of Alpha electrons:  0.1428959094E+00
 Density of Beta electrons:  0.1428959094E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3635739721E-01
 G(r) in X,Y,Z:  0.1115636606E-01  0.1449151190E-01  0.1070951924E-01
 Hamiltonian kinetic energy K(r):  0.2890821970E+00
 Potential energy density V(r): -0.3254395942E+00
 Energy density E(r) or H(r): -0.2890821970E+00
 Laplacian of electron density: -0.1010899199E+01
 Electron localization function (ELF):  0.9896736550E+00
 Localized orbital locator (LOL):  0.9073427804E+00
 Local information entropy:  0.4486368827E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2857918188E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1797763874E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8205113169E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7919031567E-02
 Wavefunction value for orbital         1 :  0.2508974662E-06
 Average local ionization energy (ALIE):  0.5611040495E+00
 Delta-g (under promolecular approximation):  0.3069480231E+00
 Delta-g (under Hirshfeld partition):  0.5347158630E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4741798030E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5012910388E-16  0.1464647021E-16  0.6714627108E-15
 Norm of gradient is:  0.6734906222E-15
 
 Components of Laplacian in x/y/z are:
 -0.1225155993E+00 -0.7792256308E+00 -0.1091579689E+00
 Total: -0.1010899199E+01
 
 Hessian matrix:
 -0.1225155993E+00 -0.4147778266E-01 -0.6518296043E+00
 -0.4147778266E-01 -0.7792256308E+00  0.3032460358E-01
 -0.6518296043E+00  0.3032460358E-01 -0.1091579689E+00
 Eigenvalues of Hessian: -0.7850082608E+00 -0.7638718984E+00  0.5379809602E+00
 Eigenvectors(columns) of Hessian:
 -0.3269199234E+00 -0.6314580893E+00 -0.7031244877E+00
 -0.9042386629E+00  0.4252895436E+00  0.3848694260E-01
 -0.2747286012E+00 -0.6483744949E+00  0.7100244433E+00
 Determinant of Hessian:  0.3225979966E+00
 Ellipticity of electron density:    0.027670
 eta index:    1.459175
 
 ----------------   CP   176,     Type (3,-1)   ----------------
 Connected atoms:    38(O )   --    29(S )
 Position (Bohr):       13.926009484163   -2.537638232025   -1.250403400980
 Position (Angstrom):    7.369326857838   -1.342860321904   -0.661684984234
 Density of all electrons:  0.2765345263E+00
 Density of Alpha electrons:  0.1382672631E+00
 Density of Beta electrons:  0.1382672631E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4490010636E+00
 G(r) in X,Y,Z:  0.2249208054E+00  0.1461475822E+00  0.7793267608E-01
 Hamiltonian kinetic energy K(r):  0.3366254086E+00
 Potential energy density V(r): -0.7856264722E+00
 Energy density E(r) or H(r): -0.3366254086E+00
 Laplacian of electron density:  0.4495026203E+00
 Electron localization function (ELF):  0.3603529246E+00
 Localized orbital locator (LOL):  0.4287644197E+00
 Local information entropy:  0.4360339336E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2765345263E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3328926803E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1328895664E-07
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2517181712E-02
 Wavefunction value for orbital         1 : -0.8314825737E-07
 Average local ionization energy (ALIE):  0.1506093063E+01
 Delta-g (under promolecular approximation):  0.2660019371E+00
 Delta-g (under Hirshfeld partition):  0.3441302104E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5392315242E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1968796796E-15 -0.1562390917E-15 -0.1468429023E-15
 Norm of gradient is:  0.2910929404E-15
 
 Components of Laplacian in x/y/z are:
  0.7659003079E+00  0.1229933365E+00 -0.4393910240E+00
 Total:  0.4495026203E+00
 
 Hessian matrix:
  0.7659003079E+00 -0.8429400712E+00 -0.2249786723E+00
 -0.8429400712E+00  0.1229933365E+00  0.1518781615E+00
 -0.2249786723E+00  0.1518781615E+00 -0.4393910240E+00
 Eigenvalues of Hessian: -0.4800193576E+00 -0.4574189453E+00  0.1386940923E+01
 Eigenvectors(columns) of Hessian:
  0.1842511549E+00 -0.5498724594E+00  0.8146728118E+00
  0.1002060961E-01 -0.8277696353E+00 -0.5609786254E+00
  0.9828281128E+00  0.1115244778E+00 -0.1470074541E+00
 Determinant of Hessian:  0.3045305467E+00
 Ellipticity of electron density:    0.049409
 eta index:    0.346099
 
 ----------------   CP   177,     Type (3,-1)   ----------------
 Connected atoms:    61(N )   --    17(C )
 Position (Bohr):       -4.991508866698   -1.229419008305   -4.744097627144
 Position (Angstrom):   -2.641392740277   -0.650580521846   -2.510468350583
 Density of all electrons:  0.3373704349E+00
 Density of Alpha electrons:  0.1686852174E+00
 Density of Beta electrons:  0.1686852174E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1756681476E+00
 G(r) in X,Y,Z:  0.7396590515E-01  0.3884748225E-01  0.6285476015E-01
 Hamiltonian kinetic energy K(r):  0.4497917925E+00
 Potential energy density V(r): -0.6254599400E+00
 Energy density E(r) or H(r): -0.4497917925E+00
 Laplacian of electron density: -0.1096494580E+01
 Electron localization function (ELF):  0.8771565467E+00
 Localized orbital locator (LOL):  0.7276920310E+00
 Local information entropy:  0.5177458756E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3373704349E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2639237133E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1726240479E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1247369975E-01
 Wavefunction value for orbital         1 : -0.5063593110E-05
 Average local ionization energy (ALIE):  0.8087325082E+00
 Delta-g (under promolecular approximation):  0.3953768385E+00
 Delta-g (under Hirshfeld partition):  0.5648978687E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5853754338E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1282611170E-15  0.1014372776E-15 -0.4891107051E-16
 Norm of gradient is:  0.1706831223E-15
 
 Components of Laplacian in x/y/z are:
 -0.7283891768E+00  0.1100940461E+00 -0.4781994490E+00
 Total: -0.1096494580E+01
 
 Hessian matrix:
 -0.7283891768E+00  0.2250055062E-01  0.4990616581E-01
  0.2250055062E-01  0.1100940461E+00  0.4820443820E+00
  0.4990616581E-01  0.4820443820E+00 -0.4781994490E+00
 Eigenvalues of Hessian: -0.7732359480E+00 -0.7056567393E+00  0.3823981076E+00
 Eigenvectors(columns) of Hessian:
 -0.6014168874E+00 -0.7979505561E+00  0.3965649365E-01
 -0.3708529854E+00  0.3227890818E+00  0.8707900275E+00
  0.7076480699E+00 -0.5090010989E+00  0.4900531508E+00
 Determinant of Hessian:  0.2086513813E+00
 Ellipticity of electron density:    0.095768
 eta index:    2.022071
 
 ----------------   CP   178,     Type (3,-1)   ----------------
 Connected atoms:    74(C )   --    66(N )
 Position (Bohr):       -0.095870416404    0.654821463683    4.091269561520
 Position (Angstrom):   -0.050732439561    0.346516595791    2.165006615618
 Density of all electrons:  0.3459471754E+00
 Density of Alpha electrons:  0.1729735877E+00
 Density of Beta electrons:  0.1729735877E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2274844602E+00
 G(r) in X,Y,Z:  0.7110669549E-01  0.6555123582E-01  0.9082652891E-01
 Hamiltonian kinetic energy K(r):  0.5236560630E+00
 Potential energy density V(r): -0.7511405232E+00
 Energy density E(r) or H(r): -0.5236560630E+00
 Laplacian of electron density: -0.1184686411E+01
 Electron localization function (ELF):  0.8223735470E+00
 Localized orbital locator (LOL):  0.6827199533E+00
 Local information entropy:  0.5290681687E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3459471754E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2871518269E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5303812885E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2274712945E-01
 Wavefunction value for orbital         1 :  0.4711781892E-06
 Average local ionization energy (ALIE):  0.8861572440E+00
 Delta-g (under promolecular approximation):  0.3585051129E+00
 Delta-g (under Hirshfeld partition):  0.5151894209E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6123326776E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1521474461E-15  0.3238376364E-15 -0.9709030455E-16
 Norm of gradient is:  0.3707373563E-15
 
 Components of Laplacian in x/y/z are:
 -0.5856466340E+00  0.5935096754E-01 -0.6583907448E+00
 Total: -0.1184686411E+01
 
 Hessian matrix:
 -0.5856466340E+00 -0.4492699930E+00 -0.1794955535E+00
 -0.4492699930E+00  0.5935096754E-01  0.2324694988E+00
 -0.1794955535E+00  0.2324694988E+00 -0.6583907448E+00
 Eigenvalues of Hessian: -0.8422269873E+00 -0.7135422877E+00  0.3710828639E+00
 Eigenvectors(columns) of Hessian:
  0.8458210788E+00 -0.2859895188E+00  0.4503295435E+00
  0.3094374968E+00 -0.4246149400E+00 -0.8508528594E+00
  0.4345516519E+00  0.8590181301E+00 -0.2706523859E+00
 Determinant of Hessian:  0.2230076542E+00
 Ellipticity of electron density:    0.180346
 eta index:    2.269647
 
 ----------------   CP   179,     Type (3,-1)   ----------------
 Connected atoms:    26(C )   --    55(H )
 Position (Bohr):       -7.431459241062    1.342146576998    2.846481020294
 Position (Angstrom):   -3.932558874124    0.710233382239    1.506292887208
 Density of all electrons:  0.2808080523E+00
 Density of Alpha electrons:  0.1404040262E+00
 Density of Beta electrons:  0.1404040262E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3652392944E-01
 G(r) in X,Y,Z:  0.6601893762E-02  0.1424938342E-01  0.1567265226E-01
 Hamiltonian kinetic energy K(r):  0.2811364269E+00
 Potential energy density V(r): -0.3176603563E+00
 Energy density E(r) or H(r): -0.2811364269E+00
 Laplacian of electron density: -0.9784499897E+00
 Electron localization function (ELF):  0.9889574843E+00
 Localized orbital locator (LOL):  0.9044539433E+00
 Local information entropy:  0.4418599729E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2808080523E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1778389113E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.9931768285E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9647991289E-02
 Wavefunction value for orbital         1 :  0.7824166384E-07
 Average local ionization energy (ALIE):  0.5555034340E+00
 Delta-g (under promolecular approximation):  0.3024103342E+00
 Delta-g (under Hirshfeld partition):  0.5251532744E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5129970851E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.6651114460E-16 -0.7017667968E-18  0.3049521898E-15
 Norm of gradient is:  0.3121218719E-15
 
 Components of Laplacian in x/y/z are:
  0.2638867843E+00 -0.7313658934E+00 -0.5109708806E+00
 Total: -0.9784499897E+00
 
 Hessian matrix:
  0.2638867843E+00  0.1804394977E+00  0.4881896614E+00
  0.1804394977E+00 -0.7313658934E+00  0.7681935335E-01
  0.4881896614E+00  0.7681935335E-01 -0.5109708806E+00
 Eigenvalues of Hessian: -0.7661544481E+00 -0.7424156981E+00  0.5301201565E+00
 Eigenvectors(columns) of Hessian:
 -0.3109980022E+00 -0.3327022636E+00  0.8902749274E+00
  0.8926614829E+00 -0.4238010163E+00  0.1534541479E+00
  0.3262448767E+00  0.8424380703E+00  0.4287917654E+00
 Determinant of Hessian:  0.3015350431E+00
 Ellipticity of electron density:    0.031975
 eta index:    1.445247
 
 ----------------   CP   180,     Type (3,-1)   ----------------
 Connected atoms:    65(N )   --    78(H )
 Position (Bohr):        3.625133048092    0.648575087955    4.695238087238
 Position (Angstrom):    1.918337795542    0.343211156105    2.484612995530
 Density of all electrons:  0.3291515905E+00
 Density of Alpha electrons:  0.1645757953E+00
 Density of Beta electrons:  0.1645757953E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4659918473E-01
 G(r) in X,Y,Z:  0.1097560619E-01  0.1055293117E-01  0.2507064737E-01
 Hamiltonian kinetic energy K(r):  0.5109722300E+00
 Potential energy density V(r): -0.5575714147E+00
 Energy density E(r) or H(r): -0.5109722300E+00
 Laplacian of electron density: -0.1857492181E+01
 Electron localization function (ELF):  0.9894108127E+00
 Localized orbital locator (LOL):  0.9062643693E+00
 Local information entropy:  0.5068527140E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3291515905E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2114496927E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2402760823E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2477116254E-01
 Wavefunction value for orbital         1 :  0.8609351103E-07
 Average local ionization energy (ALIE):  0.6877855477E+00
 Delta-g (under promolecular approximation):  0.4787937323E+00
 Delta-g (under Hirshfeld partition):  0.7237710614E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5587083035E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2509944970E-15  0.1188166996E-15 -0.1253032780E-15
 Norm of gradient is:  0.3046580987E-15
 
 Components of Laplacian in x/y/z are:
 -0.5646201797E+00 -0.3491072968E-01 -0.1257961272E+01
 Total: -0.1857492181E+01
 
 Hessian matrix:
 -0.5646201797E+00  0.9986905694E+00  0.1727094139E+00
  0.9986905694E+00 -0.3491072968E-01  0.2155187616E+00
  0.1727094139E+00  0.2155187616E+00 -0.1257961272E+01
 Eigenvalues of Hessian: -0.1333747318E+01 -0.1294772350E+01  0.7710274865E+00
 Eigenvectors(columns) of Hessian:
 -0.7960581569E+00  0.2979416318E-01  0.6044863262E+00
  0.5890145769E+00 -0.1914418083E+00  0.7851190115E+00
  0.1391159193E+00  0.9810516510E+00  0.1348496166E+00
 Determinant of Hessian:  0.1331486710E+01
 Ellipticity of electron density:    0.030102
 eta index:    1.729831
 
 ----------------   CP   181,     Type (3,-1)   ----------------
 Connected atoms:    40(H )   --    36(O )
 Position (Bohr):        2.207979320168   -1.327150280590   -3.565946381955
 Position (Angstrom):    1.168412338378   -0.702297683932   -1.887017560633
 Density of all electrons:  0.3286694156E+00
 Density of Alpha electrons:  0.1643347078E+00
 Density of Beta electrons:  0.1643347078E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.5894273254E-01
 G(r) in X,Y,Z:  0.2074608425E-01  0.1539964399E-01  0.2279700430E-01
 Hamiltonian kinetic energy K(r):  0.6278609656E+00
 Potential energy density V(r): -0.6868036981E+00
 Energy density E(r) or H(r): -0.6278609656E+00
 Laplacian of electron density: -0.2275672932E+01
 Electron localization function (ELF):  0.9830853014E+00
 Localized orbital locator (LOL):  0.8840573327E+00
 Local information entropy:  0.5062123051E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3286694156E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2152458075E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1142522325E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.4116534238E-01
 Wavefunction value for orbital         1 : -0.2572882924E-05
 Average local ionization energy (ALIE):  0.7603039317E+00
 Delta-g (under promolecular approximation):  0.4709215069E+00
 Delta-g (under Hirshfeld partition):  0.7163059743E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5835673797E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.7312943653E-16  0.2133709875E-15 -0.2591243192E-16
 Norm of gradient is:  0.2270386464E-15
 
 Components of Laplacian in x/y/z are:
 -0.9630956982E-01 -0.6192402098E+00 -0.1560123153E+01
 Total: -0.2275672932E+01
 
 Hessian matrix:
 -0.9630956982E-01 -0.1329112444E+01  0.4760745913E+00
 -0.1329112444E+01 -0.6192402098E+00 -0.4042045111E+00
  0.4760745913E+00 -0.4042045111E+00 -0.1560123153E+01
 Eigenvalues of Hessian: -0.1718729106E+01 -0.1698107721E+01  0.1141163895E+01
 Eigenvectors(columns) of Hessian:
  0.4319618484E+00  0.4978911948E+00 -0.7520061965E+00
  0.7212443228E+00  0.3099163208E+00  0.6194824461E+00
  0.5414938488E+00 -0.8099729824E+00 -0.2252291709E+00
 Determinant of Hessian:  0.3330586297E+01
 Ellipticity of electron density:    0.012144
 eta index:    1.506119
 
 ----------------   CP   182,     Type (3,-1)   ----------------
 Connected atoms:    40(H )   --    57(N )
 Position (Bohr):        3.345644291784   -1.016987725101   -2.739688922619
 Position (Angstrom):    1.770438715000   -0.538166727892   -1.449780942814
 Density of all electrons:  0.3747549020E-01
 Density of Alpha electrons:  0.1873774510E-01
 Density of Beta electrons:  0.1873774510E-01
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3330783755E-01
 G(r) in X,Y,Z:  0.2003455316E-01  0.3087775819E-02  0.1018550857E-01
 Hamiltonian kinetic energy K(r):  0.1463119465E-02
 Potential energy density V(r): -0.3477095701E-01
 Energy density E(r) or H(r): -0.1463119465E-02
 Laplacian of electron density:  0.1273788723E+00
 Electron localization function (ELF):  0.1156703755E+00
 Localized orbital locator (LOL):  0.2656624127E+00
 Local information entropy:  0.7495929441E-03
 Reduced density gradient (RDG):  0.1016467110E-14
 Reduced density gradient with promolecular approximation:  0.1939165742E+00
 Sign(lambda2)*rho: -0.3747549020E-01
 Sign(lambda2)*rho with promolecular approximation: -0.4921895601E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1502973619E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2281841787E-02
 Wavefunction value for orbital         1 :  0.6806263648E-06
 Average local ionization energy (ALIE):  0.6068410157E+00
 Delta-g (under promolecular approximation):  0.7437636810E-01
 Delta-g (under Hirshfeld partition):  0.7541049429E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5642175720E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2764715540E-17  0.7432205892E-16  0.2921924855E-16
 Norm of gradient is:  0.7990729992E-16
 
 Components of Laplacian in x/y/z are:
  0.1251905294E+00 -0.3356855160E-01  0.3575689449E-01
 Total:  0.1273788723E+00
 
 Hessian matrix:
  0.1251905294E+00  0.3853214522E-01  0.1252864697E+00
  0.3853214522E-01 -0.3356855160E-01  0.3093602003E-01
  0.1252864697E+00  0.3093602003E-01  0.3575689449E-01
 Eigenvalues of Hessian: -0.5343901230E-01 -0.4216502980E-01  0.2229829144E+00
 Eigenvectors(columns) of Hessian:
 -0.5114943444E+00 -0.3099536206E+00 -0.8014376387E+00
 -0.2753781127E+00  0.9426139518E+00 -0.1888010404E+00
  0.8139658658E+00  0.1241277200E+00 -0.5674961484E+00
 Determinant of Hessian:  0.5024379346E-03
 Ellipticity of electron density:    0.267378
 eta index:    0.239655
 
 ----------------   CP   183,     Type (3,-1)   ----------------
 Connected atoms:    60(N )   --    17(C )
 Position (Bohr):       -5.420533678951   -0.153843783261   -3.439578572521
 Position (Angstrom):   -2.868422893833   -0.081410624141   -1.820146595689
 Density of all electrons:  0.3582804332E+00
 Density of Alpha electrons:  0.1791402166E+00
 Density of Beta electrons:  0.1791402166E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2185658051E+00
 G(r) in X,Y,Z:  0.7974670311E-01  0.7778812508E-01  0.6103097695E-01
 Hamiltonian kinetic energy K(r):  0.5302688932E+00
 Potential energy density V(r): -0.7488346984E+00
 Energy density E(r) or H(r): -0.5302688932E+00
 Laplacian of electron density: -0.1246812352E+01
 Electron localization function (ELF):  0.8493183003E+00
 Localized orbital locator (LOL):  0.7036370814E+00
 Local information entropy:  0.5452708058E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3582804332E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2836993599E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1265296645E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1545076721E-01
 Wavefunction value for orbital         1 :  0.2247584977E-06
 Average local ionization energy (ALIE):  0.8510313922E+00
 Delta-g (under promolecular approximation):  0.3940441876E+00
 Delta-g (under Hirshfeld partition):  0.5687383209E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6051749332E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3935653886E-16  0.9443400922E-16  0.2963260063E-15
 Norm of gradient is:  0.3134897466E-15
 
 Components of Laplacian in x/y/z are:
 -0.5048007564E+00 -0.7842635498E+00  0.4225195386E-01
 Total: -0.1246812352E+01
 
 Hessian matrix:
 -0.5048007564E+00 -0.1417351474E+00 -0.4561748081E+00
 -0.1417351474E+00 -0.7842635498E+00  0.1952087504E+00
 -0.4561748081E+00  0.1952087504E+00  0.4225195386E-01
 Eigenvalues of Hessian: -0.8436242914E+00 -0.7544401316E+00  0.3512520707E+00
 Eigenvectors(columns) of Hessian:
 -0.3686176738E+00 -0.7920761181E+00 -0.4865556840E+00
 -0.9294601276E+00  0.3056065972E+00  0.2066602986E+00
  0.1499606011E-01 -0.5284127467E+00  0.8488551627E+00
 Determinant of Hessian:  0.2235593055E+00
 Ellipticity of electron density:    0.118212
 eta index:    2.401763
 
 ----------------   CP   184,     Type (3,-1)   ----------------
 Connected atoms:    55(H )   --    86(H )
 Position (Bohr):       -4.569298331433    1.767613489231    3.506553425525
 Position (Angstrom):   -2.417968546811    0.935380776186    1.855588161602
 Density of all electrons:  0.3894495017E-02
 Density of Alpha electrons:  0.1947247508E-02
 Density of Beta electrons:  0.1947247508E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2440130399E-02
 G(r) in X,Y,Z:  0.2210743566E-02  0.9107457523E-04  0.1383122575E-03
 Hamiltonian kinetic energy K(r): -0.5642350828E-03
 Potential energy density V(r): -0.1875895316E-02
 Energy density E(r) or H(r):  0.5642350828E-03
 Laplacian of electron density:  0.1201746193E-01
 Electron localization function (ELF):  0.1260148586E-01
 Localized orbital locator (LOL):  0.1018771006E+00
 Local information entropy:  0.9657993046E-04
 Reduced density gradient (RDG):  0.5093768729E-15
 Reduced density gradient with promolecular approximation:  0.2667431364E+00
 Sign(lambda2)*rho: -0.3894495017E-02
 Sign(lambda2)*rho with promolecular approximation: -0.1091078719E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1367959977E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1587290395E-03
 Wavefunction value for orbital         1 :  0.6142738594E-06
 Average local ionization energy (ALIE):  0.5369843704E+00
 Delta-g (under promolecular approximation):  0.1462627010E-01
 Delta-g (under Hirshfeld partition):  0.7258363995E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5020841320E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.9729232190E-18 -0.6890613026E-18  0.2312929342E-18
 Norm of gradient is:  0.1214446989E-17
 
 Components of Laplacian in x/y/z are:
  0.1737401039E-01 -0.2884666052E-02 -0.2471882415E-02
 Total:  0.1201746193E-01
 
 Hessian matrix:
  0.1737401039E-01  0.3118049888E-02  0.4204477101E-02
  0.3118049888E-02 -0.2884666052E-02  0.6532188043E-03
  0.4204477101E-02  0.6532188043E-03 -0.2471882415E-02
 Eigenvalues of Hessian: -0.3364507880E-02 -0.3316250045E-02  0.1869821985E-01
 Eigenvectors(columns) of Hessian:
 -0.3905800330E-01 -0.2421216721E+00 -0.9694594206E+00
  0.8851074931E+00  0.4418855556E+00 -0.1460201407E+00
 -0.4637447554E+00  0.8637790526E+00 -0.1970445387E+00
 Determinant of Hessian:  0.2086263119E-06
 Ellipticity of electron density:    0.014552
 eta index:    0.179937
 
 ----------------   CP   185,     Type (3,-1)   ----------------
 Connected atoms:    29(S )   --    37(O )
 Position (Bohr):       13.081734446527   -1.310841089004   -0.145567832106
 Position (Angstrom):    6.922555748187   -0.693667231416   -0.077031179391
 Density of all electrons:  0.2771426438E+00
 Density of Alpha electrons:  0.1385713219E+00
 Density of Beta electrons:  0.1385713219E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4510496341E+00
 G(r) in X,Y,Z:  0.7476445459E-01  0.1396636486E+00  0.2366215310E+00
 Hamiltonian kinetic energy K(r):  0.3374391521E+00
 Potential energy density V(r): -0.7884887862E+00
 Energy density E(r) or H(r): -0.3374391521E+00
 Laplacian of electron density:  0.4544419279E+00
 Electron localization function (ELF):  0.3599423040E+00
 Localized orbital locator (LOL):  0.4285461939E+00
 Local information entropy:  0.4368638207E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2771426438E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3334817114E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2248833262E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2750471300E-02
 Wavefunction value for orbital         1 :  0.1333294596E-06
 Average local ionization energy (ALIE):  0.1507859355E+01
 Delta-g (under promolecular approximation):  0.2670951538E+00
 Delta-g (under Hirshfeld partition):  0.3458185416E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5601825634E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1256412441E-15 -0.1317242112E-15 -0.4252444208E-16
 Norm of gradient is:  0.1869366690E-15
 
 Components of Laplacian in x/y/z are:
 -0.4617796583E+00  0.6108342215E-01  0.8551381640E+00
 Total:  0.4544419279E+00
 
 Hessian matrix:
 -0.4617796583E+00  0.6550164566E-01  0.8872644711E-01
  0.6550164566E-01  0.6108342215E-01  0.8416995941E+00
  0.8872644711E-01  0.8416995941E+00  0.8551381640E+00
 Eigenvalues of Hessian: -0.4784944278E+00 -0.4623302360E+00  0.1395266592E+01
 Eigenvectors(columns) of Hessian:
 -0.6064797297E+00  0.7928967888E+00  0.5913560542E-01
  0.6899746842E+00  0.4878761404E+00  0.5347072159E+00
 -0.3951167835E+00 -0.3650911584E+00  0.8429657012E+00
 Determinant of Hessian:  0.3086642822E+00
 Ellipticity of electron density:    0.034962
 eta index:    0.342941
 
 ----------------   CP   186,     Type (3,+3)   ----------------
 Position (Bohr):       -2.029962833849    0.275418673197   -1.068887427746
 Position (Angstrom):   -1.074210070653    0.145745285313   -0.565630867784
 Density of all electrons:  0.1391171412E-02
 Density of Alpha electrons:  0.6955857061E-03
 Density of Beta electrons:  0.6955857061E-03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8291675920E-03
 G(r) in X,Y,Z:  0.3089956812E-03  0.2340714613E-03  0.2861004496E-03
 Hamiltonian kinetic energy K(r): -0.2459659991E-03
 Potential energy density V(r): -0.5832015929E-03
 Energy density E(r) or H(r):  0.2459659991E-03
 Laplacian of electron density:  0.4300534365E-02
 Electron localization function (ELF):  0.3506305930E-02
 Localized orbital locator (LOL):  0.5663363008E-01
 Local information entropy:  0.3753388761E-04
 Reduced density gradient (RDG):  0.9274388272E-15
 Reduced density gradient with promolecular approximation:  0.9220684749E+00
 Sign(lambda2)*rho:  0.1391171412E-02
 Sign(lambda2)*rho with promolecular approximation:  0.2430656617E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3083416508E-03
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1481076594E-03
 Wavefunction value for orbital         1 : -0.1359751804E-05
 Average local ionization energy (ALIE):  0.4633613854E+00
 Delta-g (under promolecular approximation):  0.2083014905E-02
 Delta-g (under Hirshfeld partition):  0.2560031144E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5731051898E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.6903318520E-18  0.2579215324E-18 -0.4565507586E-18
 Norm of gradient is:  0.8669026346E-18
 
 Components of Laplacian in x/y/z are:
  0.1800725181E-02  0.1000371615E-02  0.1499437568E-02
 Total:  0.4300534365E-02
 
 Hessian matrix:
  0.1800725181E-02  0.2098646828E-03  0.1686802005E-03
  0.2098646828E-03  0.1000371615E-02 -0.9852581396E-03
  0.1686802005E-03 -0.9852581396E-03  0.1499437568E-02
 Eigenvalues of Hessian:  0.1885803601E-03  0.1845641864E-02  0.2266312140E-02
 Eigenvectors(columns) of Hessian:
 -0.1647137599E+00 -0.9862926926E+00  0.9803156663E-02
  0.7781658528E+00 -0.1360502743E+00 -0.6131461721E+00
  0.6060753112E+00 -0.9336512958E-01  0.7899086465E+00
 Determinant of Hessian:  0.7887940363E-09
 Ellipticity of electron density:   -0.897824
 eta index:    0.083210
 
 ----------------   CP   187,     Type (3,-1)   ----------------
 Connected atoms:    58(N )   --    57(N )
 Position (Bohr):        6.197330471221   -0.532206066344   -0.992188815331
 Position (Angstrom):    3.279486053805   -0.281631321814   -0.525043709986
 Density of all electrons:  0.4699199852E+00
 Density of Alpha electrons:  0.2349599926E+00
 Density of Beta electrons:  0.2349599926E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2929890425E+00
 G(r) in X,Y,Z:  0.4420798883E-01  0.1148995193E+00  0.1338815343E+00
 Hamiltonian kinetic energy K(r):  0.6244612094E+00
 Potential energy density V(r): -0.9174502519E+00
 Energy density E(r) or H(r): -0.6244612094E+00
 Laplacian of electron density: -0.1325888668E+01
 Electron localization function (ELF):  0.8856791927E+00
 Localized orbital locator (LOL):  0.7356940941E+00
 Local information entropy:  0.6881711194E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.4699199852E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3352308403E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2097554066E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1675100962E-01
 Wavefunction value for orbital         1 : -0.1424894000E-06
 Average local ionization energy (ALIE):  0.9034284241E+00
 Delta-g (under promolecular approximation):  0.8234431495E+00
 Delta-g (under Hirshfeld partition):  0.1057195365E+01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6164528243E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3716645047E-15 -0.3274290561E-16  0.3816391647E-15
 Norm of gradient is:  0.5337181410E-15
 
 Components of Laplacian in x/y/z are:
  0.6115767403E+00 -0.1140832830E+01 -0.7966325779E+00
 Total: -0.1325888668E+01
 
 Hessian matrix:
  0.6115767403E+00 -0.3379672995E+00  0.6842277061E+00
 -0.3379672995E+00 -0.1140832830E+01 -0.1666619006E+00
  0.6842277061E+00 -0.1666619006E+00 -0.7966325779E+00
 Eigenvalues of Hessian: -0.1213382561E+01 -0.1069133684E+01  0.9566275776E+00
 Eigenvectors(columns) of Hessian:
  0.8863070645E-01 -0.4023887157E+00  0.9111684363E+00
  0.9664732810E+00 -0.1865756780E+00 -0.1764055368E+00
  0.2409854662E+00  0.8962548956E+00  0.3723616082E+00
 Determinant of Hessian:  0.1241002505E+01
 Ellipticity of electron density:    0.134921
 eta index:    1.268396
 
 ----------------   CP   188,     Type (3,+1)   ----------------
 Position (Bohr):       -2.115043736368    0.572599431453   -0.801015201694
 Position (Angstrom):   -1.119232945349    0.303006570101   -0.423878990324
 Density of all electrons:  0.1396490983E-02
 Density of Alpha electrons:  0.6982454917E-03
 Density of Beta electrons:  0.6982454917E-03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7757737355E-03
 G(r) in X,Y,Z:  0.2736566522E-03  0.2539394866E-03  0.2481775967E-03
 Hamiltonian kinetic energy K(r): -0.2310856727E-03
 Potential energy density V(r): -0.5446880628E-03
 Energy density E(r) or H(r):  0.2310856727E-03
 Laplacian of electron density:  0.4027437633E-02
 Electron localization function (ELF):  0.4048004797E-02
 Localized orbital locator (LOL):  0.6065792087E-01
 Local information entropy:  0.3766611816E-04
 Reduced density gradient (RDG):  0.3509815468E-14
 Reduced density gradient with promolecular approximation:  0.9490085025E+00
 Sign(lambda2)*rho:  0.1396490983E-02
 Sign(lambda2)*rho with promolecular approximation:  0.2290599248E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3015971479E-03
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1373736900E-03
 Wavefunction value for orbital         1 : -0.6067765367E-06
 Average local ionization energy (ALIE):  0.4455070662E+00
 Delta-g (under promolecular approximation):  0.1901170896E-02
 Delta-g (under Hirshfeld partition):  0.2537954679E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5721352567E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2277671595E-17  0.1603459839E-17 -0.1937164350E-17
 Norm of gradient is:  0.3392856771E-17
 
 Components of Laplacian in x/y/z are:
  0.1527786525E-02  0.1237299731E-02  0.1262351377E-02
 Total:  0.4027437633E-02
 
 Hessian matrix:
  0.1527786525E-02  0.3129328787E-03  0.2690874321E-03
  0.3129328787E-03  0.1237299731E-02 -0.1334511270E-02
  0.2690874321E-03 -0.1334511270E-02  0.1262351377E-02
 Eigenvalues of Hessian: -0.1837878757E-03  0.1625979618E-02  0.2585245890E-02
 Eigenvectors(columns) of Hessian:
 -0.2339023781E+00  0.9718204529E+00  0.2923499225E-01
  0.6924370553E+00  0.1454003496E+00  0.7066750758E+00
  0.6825105142E+00  0.1855363727E+00 -0.7069339802E+00
 Determinant of Hessian: -0.7725628344E-09
 Ellipticity of electron density:   -1.113032
 eta index:    0.071091
 
 ----------------   CP   189,     Type (3,-1)   ----------------
 Connected atoms:    26(C )   --    54(H )
 Position (Bohr):       -8.848113277787    2.126225630440    1.400029787735
 Position (Angstrom):   -4.682219906093    1.125150148867    0.740863858255
 Density of all electrons:  0.2858654207E+00
 Density of Alpha electrons:  0.1429327104E+00
 Density of Beta electrons:  0.1429327104E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3579083976E-01
 G(r) in X,Y,Z:  0.1851816456E-01  0.7644819293E-02  0.9627855908E-02
 Hamiltonian kinetic energy K(r):  0.2890806597E+00
 Potential energy density V(r): -0.3248714995E+00
 Energy density E(r) or H(r): -0.2890806597E+00
 Laplacian of electron density: -0.1013159280E+01
 Electron localization function (ELF):  0.9899981983E+00
 Localized orbital locator (LOL):  0.9086903824E+00
 Local information entropy:  0.4487368276E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2858654207E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1794036896E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6415776878E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8756825608E-02
 Wavefunction value for orbital         1 : -0.1671409644E-05
 Average local ionization energy (ALIE):  0.5571723076E+00
 Delta-g (under promolecular approximation):  0.3083233721E+00
 Delta-g (under Hirshfeld partition):  0.5361020771E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4968113706E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1366313907E-15  0.9085804788E-16 -0.9526791316E-16
 Norm of gradient is:  0.1897348072E-15
 
 Components of Laplacian in x/y/z are:
 -0.7295830055E+00 -0.6180758077E-01 -0.2217686936E+00
 Total: -0.1013159280E+01
 
 Hessian matrix:
 -0.7295830055E+00 -0.1670161905E+00  0.1425991677E+00
 -0.1670161905E+00 -0.6180758077E-01 -0.6408729036E+00
  0.1425991677E+00 -0.6408729036E+00 -0.2217686936E+00
 Eigenvalues of Hessian: -0.7882561110E+00 -0.7668782405E+00  0.5419750716E+00
 Eigenvectors(columns) of Hessian:
  0.1683400936E+00 -0.9709295374E+00 -0.1701688756E+00
  0.6735974966E+00 -0.1272947074E-01  0.7389887504E+00
  0.7196721653E+00  0.2390267640E+00 -0.6518728255E+00
 Determinant of Hessian:  0.3276220119E+00
 Ellipticity of electron density:    0.027876
 eta index:    1.454414
 
 ----------------   CP   190,     Type (3,-1)   ----------------
 Connected atoms:    65(N )   --     6(C )
 Position (Bohr):        3.223028688407    0.756722695294    1.512945621095
 Position (Angstrom):    1.705553331992    0.400440405323    0.800616344019
 Density of all electrons:  0.5388464088E-02
 Density of Alpha electrons:  0.2694232044E-02
 Density of Beta electrons:  0.2694232044E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3563724126E-02
 G(r) in X,Y,Z:  0.4386499160E-03  0.7490719394E-03  0.2376002271E-02
 Hamiltonian kinetic energy K(r): -0.8754325403E-03
 Potential energy density V(r): -0.2688291586E-02
 Energy density E(r) or H(r):  0.8754325403E-03
 Laplacian of electron density:  0.1775662666E-01
 Electron localization function (ELF):  0.1739760983E-01
 Localized orbital locator (LOL):  0.1177269387E+00
 Local information entropy:  0.1299221923E-03
 Reduced density gradient (RDG):  0.1452671781E-14
 Reduced density gradient with promolecular approximation:  0.1513507722E+00
 Sign(lambda2)*rho: -0.5388464088E-02
 Sign(lambda2)*rho with promolecular approximation: -0.8554999758E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6430361961E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.3881951227E-03
 Wavefunction value for orbital         1 :  0.4214999299E-06
 Average local ionization energy (ALIE):  0.4848915171E+00
 Delta-g (under promolecular approximation):  0.1191274855E-01
 Delta-g (under Hirshfeld partition):  0.1109722835E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5786846279E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4607859233E-18 -0.6179952383E-17  0.5637851297E-17
 Norm of gradient is:  0.8377917544E-17
 
 Components of Laplacian in x/y/z are:
 -0.1029034222E-02  0.1659536426E-02  0.1712612446E-01
 Total:  0.1775662666E-01
 
 Hessian matrix:
 -0.1029034222E-02  0.1482086692E-02 -0.4555897805E-02
  0.1482086692E-02  0.1659536426E-02 -0.7716973691E-02
 -0.4555897805E-02 -0.7716973691E-02  0.1712612446E-01
 Eigenvalues of Hessian: -0.2236656328E-02 -0.1344825233E-02  0.2133810823E-01
 Eigenvectors(columns) of Hessian:
 -0.8693393797E+00 -0.4478984380E+00 -0.2088923938E+00
 -0.3534611445E+00  0.8588962746E+00 -0.3706243501E+00
 -0.3454189663E+00  0.2483629981E+00  0.9049870490E+00
 Determinant of Hessian:  0.6418314894E-07
 Ellipticity of electron density:    0.663158
 eta index:    0.104820
 
 ----------------   CP   191,     Type (3,-1)   ----------------
 Connected atoms:    29(S )   --    39(O )
 Position (Bohr):       12.761876770909   -1.291806345953   -1.982135804636
 Position (Angstrom):    6.753294355518   -0.683594479178   -1.048901096728
 Density of all electrons:  0.2769294858E+00
 Density of Alpha electrons:  0.1384647429E+00
 Density of Beta electrons:  0.1384647429E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4500030735E+00
 G(r) in X,Y,Z:  0.8578093646E-01  0.1435111458E+00  0.2207109913E+00
 Hamiltonian kinetic energy K(r):  0.3371617925E+00
 Potential energy density V(r): -0.7871648660E+00
 Energy density E(r) or H(r): -0.3371617925E+00
 Laplacian of electron density:  0.4513651241E+00
 Electron localization function (ELF):  0.3604218956E+00
 Localized orbital locator (LOL):  0.4288010503E+00
 Local information entropy:  0.4365729600E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2769294858E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3331930479E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6952408059E-07
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2767360318E-02
 Wavefunction value for orbital         1 :  0.1291895495E-07
 Average local ionization energy (ALIE):  0.1507056302E+01
 Delta-g (under promolecular approximation):  0.2667190964E+00
 Delta-g (under Hirshfeld partition):  0.3452407488E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5606766683E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3311458367E-15  0.7263985149E-16 -0.2219090797E-15
 Norm of gradient is:  0.4051885398E-15
 
 Components of Laplacian in x/y/z are:
 -0.3689141680E+00  0.9444765594E-01  0.7258316362E+00
 Total:  0.4513651241E+00
 
 Hessian matrix:
 -0.3689141680E+00 -0.2272134486E+00  0.3417369675E+00
 -0.2272134486E+00  0.9444765594E-01 -0.8269274442E+00
  0.3417369675E+00 -0.8269274442E+00  0.7258316362E+00
 Eigenvalues of Hessian: -0.4781293206E+00 -0.4614547500E+00  0.1390949195E+01
 Eigenvectors(columns) of Hessian:
 -0.4220435640E+00  0.8776780961E+00  0.2270691298E+00
  0.6869346151E+00  0.4730489862E+00 -0.5516751682E+00
  0.5916080329E+00  0.7684930881E-01  0.8025547452E+00
 Determinant of Hessian:  0.3068921397E+00
 Ellipticity of electron density:    0.036135
 eta index:    0.343743
 
 ----------------   CP   192,     Type (3,-1)   ----------------
 Connected atoms:    66(N )   --    86(H )
 Position (Bohr):       -2.165730732532    2.151497239533    4.012500379531
 Position (Angstrom):   -1.146055348608    1.138523308482    2.123323759588
 Density of all electrons:  0.3384565339E+00
 Density of Alpha electrons:  0.1692282669E+00
 Density of Beta electrons:  0.1692282669E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4863441443E-01
 G(r) in X,Y,Z:  0.8921251050E-02  0.1574017680E-01  0.2397298658E-01
 Hamiltonian kinetic energy K(r):  0.5185463388E+00
 Potential energy density V(r): -0.5671807533E+00
 Energy density E(r) or H(r): -0.5185463388E+00
 Laplacian of electron density: -0.1879647698E+01
 Electron localization function (ELF):  0.9894885360E+00
 Localized orbital locator (LOL):  0.9065793753E+00
 Local information entropy:  0.5191821828E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3384565339E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2144281955E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3738765008E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2966765246E-01
 Wavefunction value for orbital         1 : -0.1624043767E-06
 Average local ionization energy (ALIE):  0.6890569097E+00
 Delta-g (under promolecular approximation):  0.5020243951E+00
 Delta-g (under Hirshfeld partition):  0.7479661515E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5664948792E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.5179437066E-16  0.2264136009E-15  0.6570603978E-16
 Norm of gradient is:  0.2413774206E-15
 
 Components of Laplacian in x/y/z are:
  0.5218121986E+00 -0.1337210982E+01 -0.1064248914E+01
 Total: -0.1879647698E+01
 
 Hessian matrix:
  0.5218121986E+00 -0.2055521280E+00  0.6879499448E+00
 -0.2055521280E+00 -0.1337210982E+01 -0.9296676832E-01
  0.6879499448E+00 -0.9296676832E-01 -0.1064248914E+01
 Eigenvalues of Hessian: -0.1365983481E+01 -0.1315970873E+01  0.8023066565E+00
 Eigenvectors(columns) of Hessian:
  0.1892459305E-01 -0.3633864293E+00 -0.9314462748E+00
 -0.9425416682E+00 -0.3172813788E+00  0.1046314022E+00
 -0.3335521900E+00  0.8759468190E+00 -0.3485112723E+00
 Determinant of Hessian:  0.1442222012E+01
 Ellipticity of electron density:    0.038004
 eta index:    1.702570
 
 ----------------   CP   193,     Type (3,+1)   ----------------
 Position (Bohr):        3.089939667690   -0.210030781139   -2.607342628284
 Position (Angstrom):    1.635125655207   -0.111143502967   -1.379746299904
 Density of all electrons:  0.3135926036E-01
 Density of Alpha electrons:  0.1567963018E-01
 Density of Beta electrons:  0.1567963018E-01
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4308579307E-01
 G(r) in X,Y,Z:  0.2020765216E-01  0.1266037636E-01  0.1021776455E-01
 Hamiltonian kinetic energy K(r): -0.4272371809E-02
 Potential energy density V(r): -0.3881342126E-01
 Energy density E(r) or H(r):  0.4272371809E-02
 Laplacian of electron density:  0.1894326595E+00
 Electron localization function (ELF):  0.4138086381E-01
 Localized orbital locator (LOL):  0.1720588393E+00
 Local information entropy:  0.6390927339E-03
 Reduced density gradient (RDG):  0.5778996971E-14
 Reduced density gradient with promolecular approximation:  0.1187136245E+00
 Sign(lambda2)*rho:  0.3135926036E-01
 Sign(lambda2)*rho with promolecular approximation:  0.5270337521E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4861277239E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.3723527051E-02
 Wavefunction value for orbital         1 : -0.7082801768E-07
 Average local ionization energy (ALIE):  0.7650510780E+00
 Delta-g (under promolecular approximation):  0.9162242255E-01
 Delta-g (under Hirshfeld partition):  0.6813470815E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5810557105E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1563419533E-15  0.3205172672E-15  0.2802662616E-16
 Norm of gradient is:  0.3577144346E-15
 
 Components of Laplacian in x/y/z are:
  0.1137801925E+00  0.4706342867E-01  0.2858903831E-01
 Total:  0.1894326595E+00
 
 Hessian matrix:
  0.1137801925E+00 -0.6036454412E-02  0.8717700980E-01
 -0.6036454412E-02  0.4706342867E-01  0.2532933110E-01
  0.8717700980E-01  0.2532933110E-01  0.2858903831E-01
 Eigenvalues of Hessian: -0.3344184754E-01  0.5408291109E-01  0.1687915960E+00
 Eigenvectors(columns) of Hessian:
 -0.4958660766E+00 -0.2146590310E+00 -0.8414501378E+00
 -0.2942427807E+00  0.9531809953E+00 -0.6976515056E-01
  0.8170299995E+00  0.2129964569E+00 -0.5358119906E+00
 Determinant of Hessian: -0.3052819607E-03
 Ellipticity of electron density:   -1.618344
 eta index:    0.198125
 
 ----------------   CP   194,     Type (3,-1)   ----------------
 Connected atoms:    78(H )   --    35(O )
 Position (Bohr):        5.093232580649    1.664376709087    4.296069162053
 Position (Angstrom):    2.695222611508    0.880750224807    2.273381897021
 Density of all electrons:  0.1787224997E-01
 Density of Alpha electrons:  0.8936124987E-02
 Density of Beta electrons:  0.8936124987E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1570859637E-01
 G(r) in X,Y,Z:  0.9770276108E-02  0.4600777480E-02  0.1337542779E-02
 Hamiltonian kinetic energy K(r): -0.3068832621E-02
 Potential energy density V(r): -0.1263976375E-01
 Energy density E(r) or H(r):  0.3068832621E-02
 Laplacian of electron density:  0.7510971595E-01
 Electron localization function (ELF):  0.4743875968E-01
 Localized orbital locator (LOL):  0.1825417371E+00
 Local information entropy:  0.3855212832E-03
 Reduced density gradient (RDG):  0.8747775143E-15
 Reduced density gradient with promolecular approximation:  0.5245620954E+00
 Sign(lambda2)*rho: -0.1787224997E-01
 Sign(lambda2)*rho with promolecular approximation: -0.2676028719E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2162365395E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.8702927933E-03
 Wavefunction value for orbital         1 : -0.3319404727E-06
 Average local ionization energy (ALIE):  0.5805453002E+00
 Delta-g (under promolecular approximation):  0.3432978846E-01
 Delta-g (under Hirshfeld partition):  0.3126340300E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5249628178E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2183312125E-16  0.1585306864E-16 -0.6000381398E-17
 Norm of gradient is:  0.2764072260E-16
 
 Components of Laplacian in x/y/z are:
  0.7193695092E-01  0.1739693710E-01 -0.1422417208E-01
 Total:  0.7510971595E-01
 
 Hessian matrix:
  0.7193695092E-01  0.5989060953E-01 -0.2469245382E-01
  0.5989060953E-01  0.1739693710E-01 -0.1519069344E-01
 -0.2469245382E-01 -0.1519069344E-01 -0.1422417208E-01
 Eigenvalues of Hessian: -0.2151277506E-01 -0.2025941925E-01  0.1168819103E+00
 Eigenvectors(columns) of Hessian:
 -0.5519320927E+00  0.1425279815E+00  0.8216183661E+00
  0.6415850954E+00 -0.5567997352E+00  0.5275818612E+00
 -0.5326720664E+00 -0.8183274585E+00 -0.2158718144E+00
 Determinant of Hessian:  0.5094138271E-04
 Ellipticity of electron density:    0.061865
 eta index:    0.184056
 
 ----------------   CP   195,     Type (3,-1)   ----------------
 Connected atoms:    17(C )   --    59(N )
 Position (Bohr):       -4.352479693595    0.342979675797   -4.635883299745
 Position (Angstrom):   -2.303233064769    0.181497028234   -2.453203794631
 Density of all electrons:  0.3308690570E+00
 Density of Alpha electrons:  0.1654345285E+00
 Density of Beta electrons:  0.1654345285E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2016926816E+00
 G(r) in X,Y,Z:  0.7130446060E-01  0.6062681692E-01  0.6976140410E-01
 Hamiltonian kinetic energy K(r):  0.4777663287E+00
 Potential energy density V(r): -0.6794590104E+00
 Energy density E(r) or H(r): -0.4777663287E+00
 Laplacian of electron density: -0.1104294589E+01
 Electron localization function (ELF):  0.8354326212E+00
 Localized orbital locator (LOL):  0.6926131119E+00
 Local information entropy:  0.5091325821E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3308690570E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2761401987E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4461613219E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1379948561E-01
 Wavefunction value for orbital         1 : -0.4693781277E-05
 Average local ionization energy (ALIE):  0.8629387626E+00
 Delta-g (under promolecular approximation):  0.3483321741E+00
 Delta-g (under Hirshfeld partition):  0.4977230047E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5941751411E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2103352215E-15 -0.2923009057E-15 -0.1292368990E-15
 Norm of gradient is:  0.3826001842E-15
 
 Components of Laplacian in x/y/z are:
 -0.3367221362E+00 -0.2016016967E+00 -0.5659707556E+00
 Total: -0.1104294589E+01
 
 Hessian matrix:
 -0.3367221362E+00  0.4438230640E+00 -0.2282245438E+00
  0.4438230640E+00 -0.2016016967E+00 -0.3511068079E+00
 -0.2282245438E+00 -0.3511068079E+00 -0.5659707556E+00
 Eigenvalues of Hessian: -0.7882178210E+00 -0.6813886646E+00  0.3653118970E+00
 Eigenvectors(columns) of Hessian:
  0.2399938899E+00 -0.7792533923E+00 -0.5789361652E+00
 -0.6257797927E+00  0.3317400900E+00 -0.7059377903E+00
 -0.7421607534E+00 -0.5317073098E+00  0.4080254316E+00
 Determinant of Hessian:  0.1962026957E+00
 Ellipticity of electron density:    0.156782
 eta index:    2.157657
 
 ----------------   CP   196,     Type (3,-1)   ----------------
 Connected atoms:    36(O )   --    59(N )
 Position (Bohr):       -1.085703595950    0.383152947910   -4.815347697482
 Position (Angstrom):   -0.574529600772    0.202755808324   -2.548172264082
 Density of all electrons:  0.1798683129E-01
 Density of Alpha electrons:  0.8993415646E-02
 Density of Beta electrons:  0.8993415646E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1813460241E-01
 G(r) in X,Y,Z:  0.1174184375E-01  0.2919543124E-02  0.3473215530E-02
 Hamiltonian kinetic energy K(r): -0.2470025157E-02
 Potential energy density V(r): -0.1566457725E-01
 Energy density E(r) or H(r):  0.2470025157E-02
 Laplacian of electron density:  0.8241851026E-01
 Electron localization function (ELF):  0.3677496185E-01
 Localized orbital locator (LOL):  0.1635314440E+00
 Local information entropy:  0.3877493767E-03
 Reduced density gradient (RDG):  0.4458470111E-15
 Reduced density gradient with promolecular approximation:  0.2374861502E+00
 Sign(lambda2)*rho: -0.1798683129E-01
 Sign(lambda2)*rho with promolecular approximation: -0.2327144443E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4171765866E-07
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1324693773E-02
 Wavefunction value for orbital         1 : -0.2394170375E-05
 Average local ionization energy (ALIE):  0.6094407761E+00
 Delta-g (under promolecular approximation):  0.4406806629E-01
 Delta-g (under Hirshfeld partition):  0.4070364258E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5479428564E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.7250602028E-17 -0.4892462303E-17  0.4946672412E-17
 Norm of gradient is:  0.1004873052E-16
 
 Components of Laplacian in x/y/z are:
  0.7832527823E-01 -0.1310635196E-02  0.5403867230E-02
 Total:  0.8241851026E-01
 
 Hessian matrix:
  0.7832527823E-01 -0.3937842431E-01  0.3728143031E-01
 -0.3937842431E-01 -0.1310635196E-02 -0.1493946616E-01
  0.3728143031E-01 -0.1493946616E-01  0.5403867230E-02
 Eigenvalues of Hessian: -0.1750849916E-01 -0.1001158845E-01  0.1099385979E+00
 Eigenvectors(columns) of Hessian:
  0.3934976658E+00 -0.3146994841E+00 -0.8637845922E+00
  0.9183903558E+00  0.1769346689E+00  0.3539113977E+00
 -0.4145770650E-01  0.9325547478E+00 -0.3586403504E+00
 Determinant of Hessian:  0.1927090463E-04
 Ellipticity of electron density:    0.748823
 eta index:    0.159257
 
 ----------------   CP   197,     Type (3,-1)   ----------------
 Connected atoms:    58(N )   --    35(O )
 Position (Bohr):        7.320721973816    1.262038900772    1.495302812180
 Position (Angstrom):    3.873959235900    0.667842225561    0.791280171605
 Density of all electrons:  0.9954775067E-02
 Density of Alpha electrons:  0.4977387534E-02
 Density of Beta electrons:  0.4977387534E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7803459713E-02
 G(r) in X,Y,Z:  0.5395247324E-03  0.3371981018E-02  0.3891953962E-02
 Hamiltonian kinetic energy K(r): -0.1626480886E-02
 Potential energy density V(r): -0.6176978827E-02
 Energy density E(r) or H(r):  0.1626480886E-02
 Laplacian of electron density:  0.3771976239E-01
 Electron localization function (ELF):  0.2785810594E-01
 Localized orbital locator (LOL):  0.1449330034E+00
 Local information entropy:  0.2270760525E-03
 Reduced density gradient (RDG):  0.7600691003E-15
 Reduced density gradient with promolecular approximation:  0.2840759127E+00
 Sign(lambda2)*rho: -0.9954775067E-02
 Sign(lambda2)*rho with promolecular approximation: -0.9338904694E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2405994515E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.3961149898E-03
 Wavefunction value for orbital         1 :  0.5830119835E-06
 Average local ionization energy (ALIE):  0.4863499495E+00
 Delta-g (under promolecular approximation):  0.1746547928E-01
 Delta-g (under Hirshfeld partition):  0.2192281725E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5451142588E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3004372924E-17 -0.8673617380E-18  0.1051676107E-16
 Norm of gradient is:  0.1097182011E-16
 
 Components of Laplacian in x/y/z are:
 -0.7253466576E-02  0.2021292146E-01  0.2476030751E-01
 Total:  0.3771976239E-01
 
 Hessian matrix:
 -0.7253466576E-02 -0.1333357339E-02 -0.2046744158E-02
 -0.1333357339E-02  0.2021292146E-01  0.2699781958E-01
 -0.2046744158E-02  0.2699781958E-01  0.2476030751E-01
 Eigenvalues of Hessian: -0.7413349730E-02 -0.4548842437E-02  0.4968195456E-01
 Eigenvectors(columns) of Hessian:
  0.9889515011E+00  0.1420825834E+00 -0.4227845709E-01
 -0.7640919548E-01  0.7329758390E+00  0.6759497424E+00
  0.1270297732E+00 -0.6652510496E+00  0.7357339722E+00
 Determinant of Hessian:  0.1675382813E-05
 Ellipticity of electron density:    0.629722
 eta index:    0.149216
 
 ----------------   CP   198,     Type (3,+1)   ----------------
 Position (Bohr):        4.006553895692    1.870449286112    2.263969647878
 Position (Angstrom):    2.120177015855    0.989799136360    1.198041143833
 Density of all electrons:  0.4490705632E-02
 Density of Alpha electrons:  0.2245352816E-02
 Density of Beta electrons:  0.2245352816E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3163266842E-02
 G(r) in X,Y,Z:  0.6108580179E-03  0.9373830607E-03  0.1615025763E-02
 Hamiltonian kinetic energy K(r): -0.7924725614E-03
 Potential energy density V(r): -0.2370794281E-02
 Energy density E(r) or H(r):  0.7924725614E-03
 Laplacian of electron density:  0.1582295761E-01
 Electron localization function (ELF):  0.1208441922E-01
 Localized orbital locator (LOL):  0.9986874257E-01
 Local information entropy:  0.1100101518E-03
 Reduced density gradient (RDG):  0.1702572767E-14
 Reduced density gradient with promolecular approximation:  0.4440753138E-01
 Sign(lambda2)*rho:  0.4490705632E-02
 Sign(lambda2)*rho with promolecular approximation:  0.7984771122E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8144377484E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2534749369E-03
 Wavefunction value for orbital         1 :  0.4884390966E-06
 Average local ionization energy (ALIE):  0.5146218910E+00
 Delta-g (under promolecular approximation):  0.1167627852E-01
 Delta-g (under Hirshfeld partition):  0.9025686491E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5668955464E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2358139725E-17  0.3991219247E-17 -0.5800481623E-17
 Norm of gradient is:  0.7425378179E-17
 
 Components of Laplacian in x/y/z are:
  0.1045830859E-02  0.4455485410E-02  0.1032164134E-01
 Total:  0.1582295761E-01
 
 Hessian matrix:
  0.1045830859E-02  0.3099905885E-02 -0.5854316291E-03
  0.3099905885E-02  0.4455485410E-02 -0.6452522038E-02
 -0.5854316291E-03 -0.6452522038E-02  0.1032164134E-01
 Eigenvalues of Hessian: -0.1772379608E-02  0.2767888694E-02  0.1482744853E-01
 Eigenvectors(columns) of Hessian:
  0.6685363223E+00  0.7263524123E+00 -0.1595974904E+00
 -0.6690905805E+00  0.4937942234E+00 -0.5554143139E+00
 -0.3246182079E+00  0.4780998203E+00  0.8161149312E+00
 Determinant of Hessian: -0.7273974789E-07
 Ellipticity of electron density:   -1.640336
 eta index:    0.119534
 
 ----------------   CP   199,     Type (3,-1)   ----------------
 Connected atoms:    66(N )   --    70(C )
 Position (Bohr):       -0.043591425787    3.398134535021    5.142420435844
 Position (Angstrom):   -0.023067589117    1.798215355516    2.721251703530
 Density of all electrons:  0.2519453949E+00
 Density of Alpha electrons:  0.1259726975E+00
 Density of Beta electrons:  0.1259726975E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1466738943E+00
 G(r) in X,Y,Z:  0.5243507028E-01  0.3609052631E-01  0.5814829771E-01
 Hamiltonian kinetic energy K(r):  0.2987731509E+00
 Potential energy density V(r): -0.4454470452E+00
 Energy density E(r) or H(r): -0.2987731509E+00
 Laplacian of electron density: -0.6083970263E+00
 Electron localization function (ELF):  0.7946672390E+00
 Localized orbital locator (LOL):  0.6630048937E+00
 Local information entropy:  0.4022330589E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2519453949E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2367286832E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1026744283E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7854551418E-02
 Wavefunction value for orbital         1 :  0.3493862791E-06
 Average local ionization energy (ALIE):  0.7685423723E+00
 Delta-g (under promolecular approximation):  0.2604364719E+00
 Delta-g (under Hirshfeld partition):  0.3533139558E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5680590153E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4334267591E-17 -0.1906789749E-15  0.1317305640E-15
 Norm of gradient is:  0.2317977541E-15
 
 Components of Laplacian in x/y/z are:
 -0.3187621684E+00  0.6576169112E-01 -0.3553965490E+00
 Total: -0.6083970263E+00
 
 Hessian matrix:
 -0.3187621684E+00  0.2910904337E+00  0.1226073446E+00
  0.2910904337E+00  0.6576169112E-01  0.2338469895E+00
  0.1226073446E+00  0.2338469895E+00 -0.3553965490E+00
 Eigenvalues of Hessian: -0.4757382485E+00 -0.4574916329E+00  0.3248328552E+00
 Eigenvectors(columns) of Hessian:
 -0.8470365163E+00 -0.2974312003E+00  0.4405267541E+00
  0.5139272700E+00 -0.2467268580E+00  0.8215866471E+00
 -0.1356757206E+00  0.9223126035E+00  0.3618446631E+00
 Determinant of Hessian:  0.7069865870E-01
 Ellipticity of electron density:    0.039884
 eta index:    1.464563
 
 ----------------   CP   200,     Type (3,-1)   ----------------
 Connected atoms:    57(N )   --     6(C )
 Position (Bohr):        4.407249466631    1.124556296692   -1.399531672562
 Position (Angstrom):    2.332215980505    0.595089564587   -0.740600267057
 Density of all electrons:  0.3102411850E+00
 Density of Alpha electrons:  0.1551205925E+00
 Density of Beta electrons:  0.1551205925E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1884670092E+00
 G(r) in X,Y,Z:  0.6319663670E-01  0.4672882725E-01  0.7854154521E-01
 Hamiltonian kinetic energy K(r):  0.4188076726E+00
 Potential energy density V(r): -0.6072746818E+00
 Energy density E(r) or H(r): -0.4188076726E+00
 Laplacian of electron density: -0.9213626537E+00
 Electron localization function (ELF):  0.8242905656E+00
 Localized orbital locator (LOL):  0.6841476202E+00
 Local information entropy:  0.4816221131E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3102411850E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2612196966E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5721845912E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1540684920E-01
 Wavefunction value for orbital         1 :  0.3721003846E-06
 Average local ionization energy (ALIE):  0.8131341776E+00
 Delta-g (under promolecular approximation):  0.3231195305E+00
 Delta-g (under Hirshfeld partition):  0.4654480323E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6266795195E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2567390744E-15  0.5659535340E-16  0.2515349040E-16
 Norm of gradient is:  0.2641035487E-15
 
 Components of Laplacian in x/y/z are:
 -0.4344653173E+00  0.1384446705E+00 -0.6253420069E+00
 Total: -0.9213626537E+00
 
 Hessian matrix:
 -0.4344653173E+00 -0.4143380866E+00 -0.3413295260E-01
 -0.4143380866E+00  0.1384446705E+00  0.6005014617E-03
 -0.3413295260E-01  0.6005014617E-03 -0.6253420069E+00
 Eigenvalues of Hessian: -0.6713412058E+00 -0.6060035647E+00  0.3559821167E+00
 Eigenvectors(columns) of Hessian:
 -0.7449426358E+00  0.4785941723E+00 -0.4647667023E+00
 -0.3807539246E+00  0.2670462074E+00  0.8852755345E+00
 -0.5478018969E+00 -0.8364412360E+00  0.1670749621E-01
 Determinant of Hessian:  0.1448260428E+00
 Ellipticity of electron density:    0.107817
 eta index:    1.885885
 
 ----------------   CP   201,     Type (3,-1)   ----------------
 Connected atoms:    36(O )   --     1(C )
 Position (Bohr):        1.418521697770    1.039131470696   -3.132774035253
 Position (Angstrom):    0.750649355632    0.549884693424   -1.657792626365
 Density of all electrons:  0.3054458871E+00
 Density of Alpha electrons:  0.1527229435E+00
 Density of Beta electrons:  0.1527229435E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3404786207E+00
 G(r) in X,Y,Z:  0.1075750432E+00  0.1228275385E+00  0.1100760390E+00
 Hamiltonian kinetic energy K(r):  0.4811999493E+00
 Potential energy density V(r): -0.8216785699E+00
 Energy density E(r) or H(r): -0.4811999493E+00
 Laplacian of electron density: -0.5628853143E+00
 Electron localization function (ELF):  0.5771184629E+00
 Localized orbital locator (LOL):  0.5387986203E+00
 Local information entropy:  0.4751858960E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3054458871E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3000628831E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8558498613E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1246836941E-01
 Wavefunction value for orbital         1 : -0.4601598582E-06
 Average local ionization energy (ALIE):  0.1095249805E+01
 Delta-g (under promolecular approximation):  0.3119659228E+00
 Delta-g (under Hirshfeld partition):  0.3980110008E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6317660221E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5837208971E-15  0.1945844744E-14  0.1113448526E-14
 Norm of gradient is:  0.2316637536E-14
 
 Components of Laplacian in x/y/z are:
 -0.5854298235E+00  0.3770982982E+00 -0.3545537890E+00
 Total: -0.5628853143E+00
 
 Hessian matrix:
 -0.5854298235E+00  0.2507211925E+00  0.1379187800E+00
  0.2507211925E+00  0.3770982982E+00  0.5515930271E+00
  0.1379187800E+00  0.5515930271E+00 -0.3545537890E+00
 Eigenvalues of Hessian: -0.6523118520E+00 -0.6457233455E+00  0.7351498831E+00
 Eigenvectors(columns) of Hessian:
 -0.4972553941E+00  0.8413643612E+00  0.2117618588E+00
 -0.3125644400E+00 -0.4014111746E+00  0.8609137818E+00
  0.8093457505E+00  0.3619047950E+00  0.4625844522E+00
 Determinant of Hessian:  0.3096546813E+00
 Ellipticity of electron density:    0.010203
 eta index:    0.887318
 
 ----------------   CP   202,     Type (3,-1)   ----------------
 Connected atoms:    80(H )   --    70(C )
 Position (Bohr):        0.835222910469    4.004926701321    6.764431745633
 Position (Angstrom):    0.441980930244    2.119315941676    3.579583124498
 Density of all electrons:  0.2828504245E+00
 Density of Alpha electrons:  0.1414252122E+00
 Density of Beta electrons:  0.1414252122E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3649565782E-01
 G(r) in X,Y,Z:  0.1650331417E-01  0.1389146175E-01  0.6100881906E-02
 Hamiltonian kinetic energy K(r):  0.2836845255E+00
 Potential energy density V(r): -0.3201801833E+00
 Energy density E(r) or H(r): -0.2836845255E+00
 Laplacian of electron density: -0.9887554707E+00
 Electron localization function (ELF):  0.9892346934E+00
 Localized orbital locator (LOL):  0.9055588574E+00
 Local information entropy:  0.4446394316E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2828504245E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1783273088E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2431509370E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9953088970E-02
 Wavefunction value for orbital         1 :  0.2146996361E-06
 Average local ionization energy (ALIE):  0.5537232243E+00
 Delta-g (under promolecular approximation):  0.3013439596E+00
 Delta-g (under Hirshfeld partition):  0.5283900358E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5027634921E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1019150042E-15 -0.1281526968E-15 -0.1851275210E-15
 Norm of gradient is:  0.2471476902E-15
 
 Components of Laplacian in x/y/z are:
 -0.6173346677E+00 -0.7289806482E+00  0.3575598451E+00
 Total: -0.9887554707E+00
 
 Hessian matrix:
 -0.6173346677E+00 -0.8060976112E-01  0.3869328694E+00
 -0.8060976112E-01 -0.7289806482E+00 -0.2067273606E+00
  0.3869328694E+00 -0.2067273606E+00  0.3575598451E+00
 Eigenvalues of Hessian: -0.7712953468E+00 -0.7489352309E+00  0.5314751070E+00
 Eigenvectors(columns) of Hessian:
 -0.4155800571E+00 -0.8494099155E+00  0.3252629883E+00
 -0.9092382648E+00  0.3785025037E+00 -0.1732675170E+00
 -0.2406229153E-01  0.3677480797E+00  0.9296140898E+00
 Determinant of Hessian:  0.3070067330E+00
 Ellipticity of electron density:    0.029856
 eta index:    1.451235
 
 ----------------   CP   203,     Type (3,+1)   ----------------
 Position (Bohr):       -0.930787157108    1.245017359031   -4.147010670569
 Position (Angstrom):   -0.492551351743    0.658834813578   -2.194503540237
 Density of all electrons:  0.1428096857E-01
 Density of Alpha electrons:  0.7140484283E-02
 Density of Beta electrons:  0.7140484283E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1752918518E-01
 G(r) in X,Y,Z:  0.8591791778E-02  0.6045356609E-02  0.2892036796E-02
 Hamiltonian kinetic energy K(r): -0.2945889403E-02
 Potential energy density V(r): -0.1458329578E-01
 Energy density E(r) or H(r):  0.2945889403E-02
 Laplacian of electron density:  0.8190029835E-01
 Electron localization function (ELF):  0.1858502881E-01
 Localized orbital locator (LOL):  0.1210260768E+00
 Local information entropy:  0.3148410917E-03
 Reduced density gradient (RDG):  0.1056857296E-14
 Reduced density gradient with promolecular approximation:  0.2238480278E+00
 Sign(lambda2)*rho:  0.1428096857E-01
 Sign(lambda2)*rho with promolecular approximation:  0.2783171191E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1271567399E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1471604442E-02
 Wavefunction value for orbital         1 : -0.2918721419E-06
 Average local ionization energy (ALIE):  0.7050306660E+00
 Delta-g (under promolecular approximation):  0.4323396706E-01
 Delta-g (under Hirshfeld partition):  0.3072849619E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5673911507E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1481291218E-16  0.1306463618E-16  0.1246832498E-17
 Norm of gradient is:  0.1979044408E-16
 
 Components of Laplacian in x/y/z are:
  0.5277180082E-01  0.2765902234E-01  0.1469475185E-02
 Total:  0.8190029835E-01
 
 Hessian matrix:
  0.5277180082E-01 -0.2292926660E-01  0.2057951739E-01
 -0.2292926660E-01  0.2765902234E-01  0.5645272172E-02
  0.2057951739E-01  0.5645272172E-02  0.1469475185E-02
 Eigenvalues of Hessian: -0.1083480331E-01  0.2294720567E-01  0.6978789599E-01
 Eigenvectors(columns) of Hessian:
 -0.4027416415E+00  0.2899898547E+00 -0.8681618826E+00
 -0.3631169140E+00  0.8200361452E+00  0.4423650385E+00
  0.8402054968E+00  0.4934030855E+00 -0.2249624821E+00
 Determinant of Hessian: -0.1735125710E-04
 Ellipticity of electron density:   -1.472162
 eta index:    0.155253
 
 ----------------   CP   204,     Type (3,-1)   ----------------
 Connected atoms:    48(H )   --    59(N )
 Position (Bohr):       -2.466393517768    0.918425866837   -6.248205025426
 Position (Angstrom):   -1.305159242722    0.486010038634   -3.306407708505
 Density of all electrons:  0.3382103768E+00
 Density of Alpha electrons:  0.1691051884E+00
 Density of Beta electrons:  0.1691051884E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4719971210E-01
 G(r) in X,Y,Z:  0.1440769068E-01  0.1500847415E-01  0.1778354727E-01
 Hamiltonian kinetic energy K(r):  0.5223089207E+00
 Potential energy density V(r): -0.5695086328E+00
 Energy density E(r) or H(r): -0.5223089207E+00
 Laplacian of electron density: -0.1900436834E+01
 Electron localization function (ELF):  0.9900695679E+00
 Localized orbital locator (LOL):  0.9089844366E+00
 Local information entropy:  0.5188567182E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3382103768E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2142010726E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2742732745E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.2230601850E-01
 Wavefunction value for orbital         1 : -0.6458486120E-06
 Average local ionization energy (ALIE):  0.6928614867E+00
 Delta-g (under promolecular approximation):  0.4967402504E+00
 Delta-g (under Hirshfeld partition):  0.7466877440E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5382296138E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1309716224E-15 -0.2285498180E-15 -0.6505213035E-16
 Norm of gradient is:  0.2713307296E-15
 
 Components of Laplacian in x/y/z are:
 -0.4239764757E+00 -0.1064617968E+01 -0.4118423908E+00
 Total: -0.1900436834E+01
 
 Hessian matrix:
 -0.4239764757E+00 -0.5366641995E+00 -0.9168805516E+00
 -0.5366641995E+00 -0.1064617968E+01  0.5141011831E+00
 -0.9168805516E+00  0.5141011831E+00 -0.4118423908E+00
 Eigenvalues of Hessian: -0.1369708679E+01 -0.1326448533E+01  0.7957203775E+00
 Eigenvectors(columns) of Hessian:
 -0.5460931975E+00  0.5200421056E+00 -0.6567636013E+00
 -0.8343685826E+00 -0.4077486398E+00  0.3709044555E+00
 -0.7490853108E-01  0.7505313152E+00  0.6565755530E+00
 Determinant of Hessian:  0.1445703030E+01
 Ellipticity of electron density:    0.032614
 eta index:    1.721344
 
 ----------------   CP   205,     Type (3,+1)   ----------------
 Position (Bohr):       -0.160139811344    2.709403324213    0.904636914706
 Position (Angstrom):   -0.084742338721    1.433754494318    0.478713239404
 Density of all electrons:  0.2220302972E-02
 Density of Alpha electrons:  0.1110151486E-02
 Density of Beta electrons:  0.1110151486E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1392188881E-02
 G(r) in X,Y,Z:  0.1537611026E-03  0.3038364750E-03  0.9345913034E-03
 Hamiltonian kinetic energy K(r): -0.4571378050E-03
 Potential energy density V(r): -0.9350510760E-03
 Energy density E(r) or H(r):  0.4571378050E-03
 Laplacian of electron density:  0.7397306744E-02
 Electron localization function (ELF):  0.5951673584E-02
 Localized orbital locator (LOL):  0.7229898385E-01
 Local information entropy:  0.5770478333E-04
 Reduced density gradient (RDG):  0.1703625462E-14
 Reduced density gradient with promolecular approximation:  0.3340033330E+00
 Sign(lambda2)*rho:  0.2220302972E-02
 Sign(lambda2)*rho with promolecular approximation:  0.4456208834E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1026728835E-03
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2057584265E-03
 Wavefunction value for orbital         1 :  0.7087522999E-06
 Average local ionization energy (ALIE):  0.4651401892E+00
 Delta-g (under promolecular approximation):  0.4982102343E-02
 Delta-g (under Hirshfeld partition):  0.4334893183E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5737442127E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5421010862E-18  0.1517883041E-17 -0.2710505431E-17
 Norm of gradient is:  0.3153519020E-17
 
 Components of Laplacian in x/y/z are:
 -0.4712925619E-03  0.8292651651E-03  0.7039334141E-02
 Total:  0.7397306744E-02
 
 Hessian matrix:
 -0.4712925619E-03 -0.1267299338E-03 -0.1052332818E-02
 -0.1267299338E-03  0.8292651651E-03 -0.2010290193E-02
 -0.1052332818E-02 -0.2010290193E-02  0.7039334141E-02
 Eigenvalues of Hessian: -0.7609615257E-03  0.4094098602E-03  0.7748858410E-02
 Eigenvectors(columns) of Hessian:
  0.9163434519E+00 -0.3826376299E+00 -0.1179115025E+00
  0.3401127440E+00  0.8992618439E+00 -0.2750481002E+00
  0.2112770684E+00  0.2119353209E+00  0.9541726364E+00
 Determinant of Hessian: -0.2414119270E-08
 Ellipticity of electron density:   -2.858679
 eta index:    0.098203
 
 ----------------   CP   206,     Type (3,+1)   ----------------
 Position (Bohr):        6.785645982321    2.010191766931    0.389463979976
 Position (Angstrom):    3.590809215100    1.063747672605    0.206095462671
 Density of all electrons:  0.8271545175E-02
 Density of Alpha electrons:  0.4135772588E-02
 Density of Beta electrons:  0.4135772588E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.7992110746E-02
 G(r) in X,Y,Z:  0.1935852020E-02  0.4384976044E-02  0.1671282682E-02
 Hamiltonian kinetic energy K(r): -0.1552338166E-02
 Potential energy density V(r): -0.6439772580E-02
 Energy density E(r) or H(r):  0.1552338166E-02
 Laplacian of electron density:  0.3817779565E-01
 Electron localization function (ELF):  0.1452103503E-01
 Localized orbital locator (LOL):  0.1083686140E+00
 Local information entropy:  0.1919263614E-03
 Reduced density gradient (RDG):  0.9939888706E-15
 Reduced density gradient with promolecular approximation:  0.3024306307E+00
 Sign(lambda2)*rho:  0.8271545175E-02
 Sign(lambda2)*rho with promolecular approximation:  0.1471395993E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4742844199E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.4286341637E-03
 Wavefunction value for orbital         1 : -0.8850836978E-07
 Average local ionization energy (ALIE):  0.6039279693E+00
 Delta-g (under promolecular approximation):  0.2222157204E-01
 Delta-g (under Hirshfeld partition):  0.1659362214E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5629721988E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4391018799E-17  0.5448115917E-17  0.7119523680E-17
 Norm of gradient is:  0.9982516244E-17
 
 Components of Laplacian in x/y/z are:
  0.4792917774E-02  0.2959082978E-01  0.3794048097E-02
 Total:  0.3817779565E-01
 
 Hessian matrix:
  0.4792917774E-02 -0.6048684493E-02  0.2690427930E-02
 -0.6048684493E-02  0.2959082978E-01  0.1056817964E-01
  0.2690427930E-02  0.1056817964E-01  0.3794048097E-02
 Eigenvalues of Hessian: -0.2927636041E-02  0.6940082496E-02  0.3416534919E-01
 Eigenvectors(columns) of Hessian:
 -0.5404048218E+00  0.8252158223E+00 -0.1642603887E+00
 -0.3492924101E+00 -0.4241658310E-01  0.9360532280E+00
  0.7654785698E+00  0.5632225849E+00  0.3111637494E+00
 Determinant of Hessian: -0.6941727827E-06
 Ellipticity of electron density:   -1.421845
 eta index:    0.085690
 
 ----------------   CP   207,     Type (3,+1)   ----------------
 Position (Bohr):        4.015594978540    3.405744497891    4.210523393101
 Position (Angstrom):    2.124961350860    1.802242374442    2.228113025603
 Density of all electrons:  0.5256588442E-02
 Density of Alpha electrons:  0.2628294221E-02
 Density of Beta electrons:  0.2628294221E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3503071711E-02
 G(r) in X,Y,Z:  0.2241361351E-02  0.9695353782E-03  0.2921749817E-03
 Hamiltonian kinetic energy K(r): -0.7805661437E-03
 Potential energy density V(r): -0.2722505567E-02
 Energy density E(r) or H(r):  0.7805661437E-03
 Laplacian of electron density:  0.1713455142E-01
 Electron localization function (ELF):  0.1658992361E-01
 Localized orbital locator (LOL):  0.1152435413E+00
 Local information entropy:  0.1270184661E-03
 Reduced density gradient (RDG):  0.1818918990E-14
 Reduced density gradient with promolecular approximation:  0.4275066039E+00
 Sign(lambda2)*rho:  0.5256588442E-02
 Sign(lambda2)*rho with promolecular approximation:  0.8995431368E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1463450796E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2022476488E-03
 Wavefunction value for orbital         1 : -0.9675010377E-06
 Average local ionization energy (ALIE):  0.5129302133E+00
 Delta-g (under promolecular approximation):  0.1247237293E-01
 Delta-g (under Hirshfeld partition):  0.1003463013E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5246008859E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.6043368320E-17 -0.8270641455E-17 -0.1135024149E-18
 Norm of gradient is:  0.1024395888E-16
 
 Components of Laplacian in x/y/z are:
  0.1570276033E-01  0.3808001585E-02 -0.2376210502E-02
 Total:  0.1713455142E-01
 
 Hessian matrix:
  0.1570276033E-01 -0.5273442614E-02 -0.3154588453E-02
 -0.5273442614E-02  0.3808001585E-02 -0.1414418328E-03
 -0.3154588453E-02 -0.1414418328E-03 -0.2376210502E-02
 Eigenvalues of Hessian: -0.3099475355E-02  0.2117934390E-02  0.1811609238E-01
 Eigenvectors(columns) of Hessian:
  0.2120226741E+00  0.3020537676E+00 -0.9294137438E+00
  0.1815293664E+00  0.9223117357E+00  0.3411570772E+00
  0.9602569837E+00 -0.2410489239E+00  0.1407193715E+00
 Determinant of Hessian: -0.1189228248E-06
 Ellipticity of electron density:   -2.463443
 eta index:    0.171090
 
 ----------------   CP   208,     Type (3,+3)   ----------------
 Position (Bohr):        0.649267442282    2.975412900682    1.144005087336
 Position (Angstrom):    0.343577534237    1.574520700068    0.605381421375
 Density of all electrons:  0.2098765594E-02
 Density of Alpha electrons:  0.1049382797E-02
 Density of Beta electrons:  0.1049382797E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1568423562E-02
 G(r) in X,Y,Z:  0.3985106122E-03  0.4639295016E-03  0.7059834484E-03
 Hamiltonian kinetic energy K(r): -0.5132848782E-03
 Potential energy density V(r): -0.1055138684E-02
 Energy density E(r) or H(r):  0.5132848782E-03
 Laplacian of electron density:  0.8326833762E-02
 Electron localization function (ELF):  0.3901266098E-02
 Localized orbital locator (LOL):  0.5924969998E-01
 Local information entropy:  0.5479639034E-04
 Reduced density gradient (RDG):  0.2041576029E-14
 Reduced density gradient with promolecular approximation:  0.3996549116E+00
 Sign(lambda2)*rho:  0.2098765594E-02
 Sign(lambda2)*rho with promolecular approximation:  0.5188951945E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4857684356E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2036844530E-03
 Wavefunction value for orbital         1 :  0.5847068571E-06
 Average local ionization energy (ALIE):  0.4990873209E+00
 Delta-g (under promolecular approximation):  0.5295087601E-02
 Delta-g (under Hirshfeld partition):  0.3995725413E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5747206396E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1617832929E-18 -0.1816038639E-17 -0.2818925648E-17
 Norm of gradient is:  0.3357158320E-17
 
 Components of Laplacian in x/y/z are:
  0.1517262427E-02  0.1912723445E-02  0.4896847889E-02
 Total:  0.8326833762E-02
 
 Hessian matrix:
  0.1517262427E-02  0.5324104289E-03 -0.1465506494E-02
  0.5324104289E-03  0.1912723445E-02 -0.1506168704E-02
 -0.1465506494E-02 -0.1506168704E-02  0.4896847889E-02
 Eigenvalues of Hessian:  0.9682195674E-03  0.1299486351E-02  0.6059127844E-02
 Eigenvectors(columns) of Hessian:
 -0.9247091648E+00 -0.1991103866E+00 -0.3244503267E+00
 -0.7416428718E-01  0.9302020283E+00 -0.3594771830E+00
 -0.3733799928E+00  0.3083492184E+00  0.8749332206E+00
 Determinant of Hessian:  0.7623522624E-08
 Ellipticity of electron density:   -0.254921
 eta index:    0.159795
 
 ----------------   CP   209,     Type (3,-1)   ----------------
 Connected atoms:     1(C )   --     6(C )
 Position (Bohr):        2.783495952670    1.885026941439   -2.051202913452
 Position (Angstrom):    1.472962624794    0.997513299348   -1.085449836737
 Density of all electrons:  0.3103534289E+00
 Density of Alpha electrons:  0.1551767144E+00
 Density of Beta electrons:  0.1551767144E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.9961198970E-01
 G(r) in X,Y,Z:  0.1974032418E-01  0.3310413305E-01  0.4676753247E-01
 Hamiltonian kinetic energy K(r):  0.3225406435E+00
 Potential energy density V(r): -0.4221526332E+00
 Energy density E(r) or H(r): -0.3225406435E+00
 Laplacian of electron density: -0.8917146150E+00
 Electron localization function (ELF):  0.9438575687E+00
 Localized orbital locator (LOL):  0.8039460176E+00
 Local information entropy:  0.4817725770E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3103534289E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2122322736E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1220364958E-02
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1801895446E-01
 Wavefunction value for orbital         1 : -0.2319905740E-06
 Average local ionization energy (ALIE):  0.6812101171E+00
 Delta-g (under promolecular approximation):  0.3626766013E+00
 Delta-g (under Hirshfeld partition):  0.5610242511E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6222768068E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.6502502529E-16 -0.5532141585E-16  0.6884683795E-17
 Norm of gradient is:  0.8565110529E-16
 
 Components of Laplacian in x/y/z are:
  0.1059722293E+00 -0.6632723938E+00 -0.3344144506E+00
 Total: -0.8917146150E+00
 
 Hessian matrix:
  0.1059722293E+00  0.8929475901E-01  0.3869584904E+00
  0.8929475901E-01 -0.6632723938E+00  0.5010149864E-02
  0.3869584904E+00  0.5010149864E-02 -0.3344144506E+00
 Eigenvalues of Hessian: -0.6828668375E+00 -0.5462092718E+00  0.3373614943E+00
 Eigenvectors(columns) of Hessian:
  0.2208883779E+00 -0.4533670423E+00 -0.8635199184E+00
 -0.9473829704E+00 -0.3100595389E+00 -0.7955243413E-01
 -0.2316761360E+00  0.8356562734E+00 -0.4980007638E+00
 Determinant of Hessian:  0.1258318559E+00
 Ellipticity of electron density:    0.250193
 eta index:    2.024140
 
 ----------------   CP   210,     Type (3,-1)   ----------------
 Connected atoms:    58(N )   --    34(O )
 Position (Bohr):        8.125131463936    2.029183726705    0.109519806587
 Position (Angstrom):    4.299634406306    1.073797784907    0.057955385788
 Density of all electrons:  0.8825418379E-02
 Density of Alpha electrons:  0.4412709189E-02
 Density of Beta electrons:  0.4412709189E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.6843883952E-02
 G(r) in X,Y,Z:  0.9638324143E-03  0.5020429574E-02  0.8596219636E-03
 Hamiltonian kinetic energy K(r): -0.1447855271E-02
 Potential energy density V(r): -0.5396028681E-02
 Energy density E(r) or H(r):  0.1447855271E-02
 Laplacian of electron density:  0.3316695689E-01
 Electron localization function (ELF):  0.2432319777E-01
 Localized orbital locator (LOL):  0.1365328825E+00
 Local information entropy:  0.2035660954E-03
 Reduced density gradient (RDG):  0.2196813072E-15
 Reduced density gradient with promolecular approximation:  0.3403716135E+00
 Sign(lambda2)*rho: -0.8825418379E-02
 Sign(lambda2)*rho with promolecular approximation:  0.8979824636E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4676784904E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.3151302914E-03
 Wavefunction value for orbital         1 :  0.1005988373E-06
 Average local ionization energy (ALIE):  0.4945318534E+00
 Delta-g (under promolecular approximation):  0.1439784699E-01
 Delta-g (under Hirshfeld partition):  0.1779669328E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5356163184E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.5082197684E-18 -0.1897353802E-17  0.1070649645E-17
 Norm of gradient is:  0.2237080563E-17
 
 Components of Laplacian in x/y/z are:
 -0.4998492018E-03  0.3604237267E-01 -0.2375566580E-02
 Total:  0.3316695689E-01
 
 Hessian matrix:
 -0.4998492018E-03  0.1107788000E-01 -0.4089315498E-03
  0.1107788000E-01  0.3604237267E-01  0.7833209825E-02
 -0.4089315498E-03  0.7833209825E-02 -0.2375566580E-02
 Eigenvalues of Hessian: -0.6098774508E-02 -0.1167898287E-02  0.4043362969E-01
 Eigenvectors(columns) of Hessian:
 -0.6452904984E+00 -0.7198524495E+00  0.2557589170E+00
  0.3002079714E+00  0.6890714927E-01  0.9513816157E+00
 -0.7024780044E+00  0.6906983826E+00  0.1716403149E+00
 Determinant of Hessian:  0.2879985672E-06
 Ellipticity of electron density:    4.222008
 eta index:    0.150834
 
 ----------------   CP   211,     Type (3,-1)   ----------------
 Connected atoms:    37(O )   --    34(O )
 Position (Bohr):       11.270777077444    2.092261963797    0.672777045134
 Position (Angstrom):    5.964238378551    1.107177350481    0.356018280304
 Density of all electrons:  0.4300504141E-02
 Density of Alpha electrons:  0.2150252071E-02
 Density of Beta electrons:  0.2150252071E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2899741291E-02
 G(r) in X,Y,Z:  0.9619050999E-03  0.1693347677E-02  0.2444885134E-03
 Hamiltonian kinetic energy K(r): -0.7864827089E-03
 Potential energy density V(r): -0.2113258582E-02
 Energy density E(r) or H(r):  0.7864827089E-03
 Laplacian of electron density:  0.1474489600E-01
 Electron localization function (ELF):  0.1243724979E-01
 Localized orbital locator (LOL):  0.1012120442E+00
 Local information entropy:  0.1057450417E-03
 Reduced density gradient (RDG):  0.5655425040E-15
 Reduced density gradient with promolecular approximation:  0.1129615580E+00
 Sign(lambda2)*rho: -0.4300504141E-02
 Sign(lambda2)*rho with promolecular approximation: -0.2332338795E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1590710691E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1021819809E-03
 Wavefunction value for orbital         1 : -0.2422269777E-06
 Average local ionization energy (ALIE):  0.4619571799E+00
 Delta-g (under promolecular approximation):  0.6269424996E-02
 Delta-g (under Hirshfeld partition):  0.9822885075E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4600410985E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1193045906E-17  0.2275977529E-17  0.8798554740E-18
 Norm of gradient is:  0.2716169712E-17
 
 Components of Laplacian in x/y/z are:
  0.4866072110E-02  0.1186819769E-01 -0.1989373806E-02
 Total:  0.1474489600E-01
 
 Hessian matrix:
  0.4866072110E-02 -0.1032206926E-01  0.2419543060E-02
 -0.1032206926E-01  0.1186819769E-01 -0.3139522428E-02
  0.2419543060E-02 -0.3139522428E-02 -0.1989373806E-02
 Eigenvalues of Hessian: -0.2778183290E-02 -0.2457968663E-02  0.1998104795E-01
 Eigenvectors(columns) of Hessian:
 -0.4824927108E+00 -0.6614235062E+00  0.5742122686E+00
 -0.1552574895E+00 -0.5806050165E+00 -0.7992452231E+00
  0.8620301015E+00 -0.4747807496E+00  0.1774467353E+00
 Determinant of Hessian:  0.1364443317E-06
 Ellipticity of electron density:    0.130276
 eta index:    0.139041
 
 ----------------   CP   212,     Type (3,+1)   ----------------
 Position (Bohr):       10.875408002171    1.731379598613   -0.938109453379
 Position (Angstrom):    5.755018074021    0.916206627009   -0.496426144061
 Density of all electrons:  0.3035598744E-02
 Density of Alpha electrons:  0.1517799372E-02
 Density of Beta electrons:  0.1517799372E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2107221232E-02
 G(r) in X,Y,Z:  0.5168248229E-03  0.9889119212E-03  0.6014844882E-03
 Hamiltonian kinetic energy K(r): -0.5523052904E-03
 Potential energy density V(r): -0.1554915942E-02
 Energy density E(r) or H(r):  0.5523052904E-03
 Laplacian of electron density:  0.1063810609E-01
 Electron localization function (ELF):  0.7393718795E-02
 Localized orbital locator (LOL):  0.7979634781E-01
 Local information entropy:  0.7688249093E-04
 Reduced density gradient (RDG):  0.1039916028E-14
 Reduced density gradient with promolecular approximation:  0.5648805510E+00
 Sign(lambda2)*rho:  0.3035598744E-02
 Sign(lambda2)*rho with promolecular approximation:  0.1985270484E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3212022756E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.7659558969E-04
 Wavefunction value for orbital         1 : -0.4877141548E-06
 Average local ionization energy (ALIE):  0.4711330939E+00
 Delta-g (under promolecular approximation):  0.4229741700E-02
 Delta-g (under Hirshfeld partition):  0.6369586106E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4705364802E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1155895571E-17 -0.2408961702E-17 -0.1212898241E-17
 Norm of gradient is:  0.2934333518E-17
 
 Components of Laplacian in x/y/z are:
  0.1864113710E-02  0.6431698862E-02  0.2342293519E-02
 Total:  0.1063810609E-01
 
 Hessian matrix:
  0.1864113710E-02 -0.4155012893E-02 -0.1593423249E-02
 -0.4155012893E-02  0.6431698862E-02  0.3047056786E-02
 -0.1593423249E-02  0.3047056786E-02  0.2342293519E-02
 Eigenvalues of Hessian: -0.6122287149E-03  0.8900043547E-03  0.1036033045E-01
 Eigenvectors(columns) of Hessian:
  0.8362446771E+00 -0.2948020575E+00 -0.4623706163E+00
  0.5383611133E+00  0.2811200066E+00  0.7944424798E+00
 -0.1042216469E+00 -0.9132706548E+00  0.3937950730E+00
 Determinant of Hessian: -0.5645201321E-08
 Ellipticity of electron density:   -1.687894
 eta index:    0.059094
 
 ----------------   CP   213,     Type (3,-1)   ----------------
 Connected atoms:    35(O )   --    79(H )
 Position (Bohr):        4.137880099256    3.907900321630    3.994953908364
 Position (Angstrom):    2.189671849975    2.067971792687    2.114038566914
 Density of all electrons:  0.5337003295E-02
 Density of Alpha electrons:  0.2668501648E-02
 Density of Beta electrons:  0.2668501648E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3513429312E-02
 G(r) in X,Y,Z:  0.2531630709E-02  0.5446649753E-03  0.4371336283E-03
 Hamiltonian kinetic energy K(r): -0.7848125648E-03
 Potential energy density V(r): -0.2728616748E-02
 Energy density E(r) or H(r):  0.7848125648E-03
 Laplacian of electron density:  0.1719296751E-01
 Electron localization function (ELF):  0.1733549403E-01
 Localized orbital locator (LOL):  0.1175421882E+00
 Local information entropy:  0.1287899171E-03
 Reduced density gradient (RDG):  0.1877561514E-14
 Reduced density gradient with promolecular approximation:  0.4694957552E+00
 Sign(lambda2)*rho: -0.5337003295E-02
 Sign(lambda2)*rho with promolecular approximation:  0.8336762274E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6120083597E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1967557802E-03
 Wavefunction value for orbital         1 : -0.5928596851E-06
 Average local ionization energy (ALIE):  0.4991751175E+00
 Delta-g (under promolecular approximation):  0.1202902064E-01
 Delta-g (under Hirshfeld partition):  0.1016438769E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5251774713E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.9757396036E-17 -0.3211948936E-17 -0.9486769009E-19
 Norm of gradient is:  0.1027289605E-16
 
 Components of Laplacian in x/y/z are:
  0.1847507523E-01 -0.1481711939E-03 -0.1133936529E-02
 Total:  0.1719296751E-01
 
 Hessian matrix:
  0.1847507523E-01 -0.5826287473E-02 -0.4084695416E-02
 -0.5826287473E-02 -0.1481711939E-03  0.1263438138E-03
 -0.4084695416E-02  0.1263438138E-03 -0.1133936529E-02
 Eigenvalues of Hessian: -0.2824445716E-02 -0.8449313062E-03  0.2086234453E-01
 Eigenvectors(columns) of Hessian:
 -0.3100802826E+00 -0.7111773471E-01 -0.9480466688E+00
 -0.6419437285E+00 -0.7198826806E+00  0.2639643453E+00
 -0.7012549235E+00  0.6904427521E+00  0.1775678413E+00
 Determinant of Hessian:  0.4978720513E-07
 Ellipticity of electron density:    2.342811
 eta index:    0.135385
 
 ----------------   CP   214,     Type (3,-1)   ----------------
 Connected atoms:    70(C )   --    79(H )
 Position (Bohr):        1.472276237833    4.540370460128    4.783479427587
 Position (Angstrom):    0.779095033215    2.402660576557    2.531308301902
 Density of all electrons:  0.2853019526E+00
 Density of Alpha electrons:  0.1426509763E+00
 Density of Beta electrons:  0.1426509763E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3776977745E-01
 G(r) in X,Y,Z:  0.9401779171E-02  0.1511299521E-01  0.1325500307E-01
 Hamiltonian kinetic energy K(r):  0.2884683770E+00
 Potential energy density V(r): -0.3262381545E+00
 Energy density E(r) or H(r): -0.2884683770E+00
 Laplacian of electron density: -0.1002794398E+01
 Electron localization function (ELF):  0.9888019658E+00
 Localized orbital locator (LOL):  0.9038403268E+00
 Local information entropy:  0.4479715855E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2853019526E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1798681129E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5171318399E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1180902207E-01
 Wavefunction value for orbital         1 : -0.1044779981E-06
 Average local ionization energy (ALIE):  0.5558307554E+00
 Delta-g (under promolecular approximation):  0.3033485794E+00
 Delta-g (under Hirshfeld partition):  0.5322187836E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5446013575E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3754050022E-15 -0.5189262648E-16 -0.1530893468E-15
 Norm of gradient is:  0.4087274256E-15
 
 Components of Laplacian in x/y/z are:
  0.7472075884E-01 -0.7018088710E+00 -0.3757062862E+00
 Total: -0.1002794398E+01
 
 Hessian matrix:
  0.7472075884E-01  0.2363636878E+00 -0.5761242242E+00
  0.2363636878E+00 -0.7018088710E+00 -0.1748519614E+00
 -0.5761242242E+00 -0.1748519614E+00 -0.3757062862E+00
 Eigenvalues of Hessian: -0.7811486090E+00 -0.7593742672E+00  0.5377284777E+00
 Eigenvectors(columns) of Hessian:
 -0.2356322641E+00 -0.5481794406E+00 -0.8024816117E+00
 -0.7248033382E+00  0.6492005145E+00 -0.2306486785E+00
 -0.6474083387E+00 -0.5272930806E+00  0.5502948755E+00
 Determinant of Hessian:  0.3189720113E+00
 Ellipticity of electron density:    0.028674
 eta index:    1.452682
 
 ----------------   CP   215,     Type (3,-1)   ----------------
 Connected atoms:    39(O )   --    34(O )
 Position (Bohr):       10.770400636092    1.917037963633   -1.354328235517
 Position (Angstrom):    5.699450568915    1.014452802791   -0.716679638318
 Density of all electrons:  0.3065842266E-02
 Density of Alpha electrons:  0.1532921133E-02
 Density of Beta electrons:  0.1532921133E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2067614078E-02
 G(r) in X,Y,Z:  0.4809923323E-03  0.1005140212E-02  0.5814815337E-03
 Hamiltonian kinetic energy K(r): -0.5633123810E-03
 Potential energy density V(r): -0.1504301697E-02
 Energy density E(r) or H(r):  0.5633123810E-03
 Laplacian of electron density:  0.1052370584E-01
 Electron localization function (ELF):  0.7931979049E-02
 Localized orbital locator (LOL):  0.8244208011E-01
 Local information entropy:  0.7758407404E-04
 Reduced density gradient (RDG):  0.1380926699E-14
 Reduced density gradient with promolecular approximation:  0.3699698084E+00
 Sign(lambda2)*rho: -0.3065842266E-02
 Sign(lambda2)*rho with promolecular approximation: -0.1819086612E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2810514333E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.7597163108E-04
 Wavefunction value for orbital         1 : -0.3699982707E-06
 Average local ionization energy (ALIE):  0.4671305065E+00
 Delta-g (under promolecular approximation):  0.4297191305E-02
 Delta-g (under Hirshfeld partition):  0.6727119611E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4661994226E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1657590538E-17 -0.2415949724E-17 -0.2381009615E-17
 Norm of gradient is:  0.3775397495E-17
 
 Components of Laplacian in x/y/z are:
  0.1555489992E-02  0.6605844308E-02  0.2362371537E-02
 Total:  0.1052370584E-01
 
 Hessian matrix:
  0.1555489992E-02 -0.4356337401E-02 -0.2882749614E-02
 -0.4356337401E-02  0.6605844308E-02  0.4754505968E-02
 -0.2882749614E-02  0.4754505968E-02  0.2362371537E-02
 Eigenvalues of Hessian: -0.1003851351E-02 -0.7159597604E-03  0.1224351695E-01
 Eigenvectors(columns) of Hessian:
  0.8884798295E+00  0.1333944664E+00 -0.4391007958E+00
  0.2828258376E+00  0.5943532177E+00  0.7528305242E+00
  0.3614043969E+00 -0.7930637862E+00  0.4903434438E+00
 Determinant of Hessian:  0.8799625888E-08
 Ellipticity of electron density:    0.402106
 eta index:    0.081990
 
 ----------------   CP   216,     Type (3,+1)   ----------------
 Position (Bohr):        4.115997034248    4.133676696027    3.651679034651
 Position (Angstrom):    2.178091830668    2.187447504778    1.932385326669
 Density of all electrons:  0.5307028738E-02
 Density of Alpha electrons:  0.2653514369E-02
 Density of Beta electrons:  0.2653514369E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3579731493E-02
 G(r) in X,Y,Z:  0.2321525852E-02  0.4633055293E-03  0.7949001115E-03
 Hamiltonian kinetic energy K(r): -0.7547623963E-03
 Potential energy density V(r): -0.2824969097E-02
 Energy density E(r) or H(r):  0.7547623963E-03
 Laplacian of electron density:  0.1733797556E-01
 Electron localization function (ELF):  0.1640592101E-01
 Localized orbital locator (LOL):  0.1146604714E+00
 Local information entropy:  0.1281299127E-03
 Reduced density gradient (RDG):  0.1210634237E-14
 Reduced density gradient with promolecular approximation:  0.3721206943E+00
 Sign(lambda2)*rho:  0.5307028738E-02
 Sign(lambda2)*rho with promolecular approximation:  0.8749904086E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1304385328E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2004780114E-03
 Wavefunction value for orbital         1 : -0.3012162109E-06
 Average local ionization energy (ALIE):  0.5048631294E+00
 Delta-g (under promolecular approximation):  0.1342269770E-01
 Delta-g (under Hirshfeld partition):  0.1028427865E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5311827584E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.9969577789E-18  0.1151964808E-18 -0.7101524230E-17
 Norm of gradient is:  0.7172087662E-17
 
 Components of Laplacian in x/y/z are:
  0.1633119892E-01 -0.9448023468E-03  0.1951578980E-02
 Total:  0.1733797556E-01
 
 Hessian matrix:
  0.1633119892E-01 -0.4238934329E-02 -0.4875340939E-02
 -0.4238934329E-02 -0.9448023468E-03 -0.2896530850E-03
 -0.4875340939E-02 -0.2896530850E-03  0.1951578980E-02
 Eigenvalues of Hessian: -0.2501736605E-02  0.1202447642E-02  0.1863726452E-01
 Eigenvectors(columns) of Hessian:
 -0.2957636110E+00  0.1618846438E+00 -0.9414442355E+00
 -0.8760903915E+00 -0.4388106126E+00  0.1997770563E+00
 -0.3807748841E+00  0.8838770324E+00  0.2716097922E+00
 Determinant of Hessian: -0.5606475485E-07
 Ellipticity of electron density:   -3.080537
 eta index:    0.134233
 
 ----------------   CP   217,     Type (3,-1)   ----------------
 Connected atoms:     1(C )   --     2(C )
 Position (Bohr):        0.655758468025    2.815332234471   -2.790918279041
 Position (Angstrom):    0.347012437135    1.489809659603   -1.476890350761
 Density of all electrons:  0.3033355407E+00
 Density of Alpha electrons:  0.1516677704E+00
 Density of Beta electrons:  0.1516677704E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8801852943E-01
 G(r) in X,Y,Z:  0.2361465202E-01  0.1912755480E-01  0.4527632261E-01
 Hamiltonian kinetic energy K(r):  0.3112246878E+00
 Potential energy density V(r): -0.3992432172E+00
 Energy density E(r) or H(r): -0.3112246878E+00
 Laplacian of electron density: -0.8928246334E+00
 Electron localization function (ELF):  0.9522699240E+00
 Localized orbital locator (LOL):  0.8170902974E+00
 Local information entropy:  0.4723483635E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3033355407E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2085584721E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.6732307309E-03
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1768205381E-01
 Wavefunction value for orbital         1 :  0.1918538150E-08
 Average local ionization energy (ALIE):  0.6817036216E+00
 Delta-g (under promolecular approximation):  0.3562834594E+00
 Delta-g (under Hirshfeld partition):  0.5502209786E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6158933890E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2429697069E-15  0.2569559149E-15 -0.1062518129E-15
 Norm of gradient is:  0.3692561014E-15
 
 Components of Laplacian in x/y/z are:
 -0.2062184804E+00 -0.9440240248E-01 -0.5922037505E+00
 Total: -0.8928246334E+00
 
 Hessian matrix:
 -0.2062184804E+00 -0.4746410685E+00 -0.1394127146E-01
 -0.4746410685E+00 -0.9440240248E-01 -0.4196191658E-01
 -0.1394127146E-01 -0.4196191658E-01 -0.5922037505E+00
 Eigenvalues of Hessian: -0.6526876892E+00 -0.5682802929E+00  0.3281433487E+00
 Eigenvectors(columns) of Hessian:
  0.6217727387E+00  0.4160532895E+00  0.6635497884E+00
  0.5690624091E+00  0.3421173317E+00 -0.7477457495E+00
  0.5381139618E+00 -0.8425291637E+00  0.2404105696E-01
 Determinant of Hessian:  0.1217115022E+00
 Ellipticity of electron density:    0.148531
 eta index:    1.989032
 
 ----------------   CP   218,     Type (3,-1)   ----------------
 Connected atoms:    59(N )   --     7(C )
 Position (Bohr):       -2.936913966072    2.787868418796   -4.457249828350
 Position (Angstrom):   -1.554147941228    1.475276434223   -2.358675032464
 Density of all electrons:  0.2828133119E+00
 Density of Alpha electrons:  0.1414066560E+00
 Density of Beta electrons:  0.1414066560E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1471955977E+00
 G(r) in X,Y,Z:  0.5673286006E-01  0.3726349105E-01  0.5319924664E-01
 Hamiltonian kinetic energy K(r):  0.3474434488E+00
 Potential energy density V(r): -0.4946390465E+00
 Energy density E(r) or H(r): -0.3474434488E+00
 Laplacian of electron density: -0.8009914042E+00
 Electron localization function (ELF):  0.8495964744E+00
 Localized orbital locator (LOL):  0.7038684629E+00
 Local information entropy:  0.4445889531E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2828133119E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2454265504E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8521024778E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1058462918E-01
 Wavefunction value for orbital         1 : -0.5334351959E-06
 Average local ionization energy (ALIE):  0.7936892037E+00
 Delta-g (under promolecular approximation):  0.3078734789E+00
 Delta-g (under Hirshfeld partition):  0.4312881416E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5909334262E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3057450126E-16 -0.1369347344E-15  0.7155734338E-16
 Norm of gradient is:  0.1575003968E-15
 
 Components of Laplacian in x/y/z are:
 -0.4993281279E+00  0.3260774647E-01 -0.3342710227E+00
 Total: -0.8009914042E+00
 
 Hessian matrix:
 -0.4993281279E+00  0.2202384337E+00  0.1507853568E+00
  0.2202384337E+00  0.3260774647E-01  0.3750277483E+00
  0.1507853568E+00  0.3750277483E+00 -0.3342710227E+00
 Eigenvalues of Hessian: -0.5887351498E+00 -0.5626188349E+00  0.3503625806E+00
 Eigenvectors(columns) of Hessian:
  0.8438327209E+00 -0.4452578613E+00  0.2994858529E+00
  0.2444533405E-01  0.5894286967E+00  0.8074504549E+00
 -0.5360492186E+00 -0.6740320827E+00  0.5082636981E+00
 Determinant of Hessian:  0.1160518183E+00
 Ellipticity of electron density:    0.046419
 eta index:    1.680360
 
 ----------------   CP   219,     Type (3,-1)   ----------------
 Connected atoms:    70(C )   --    71(C )
 Position (Bohr):       -0.534293857981    5.385096739640    5.507178898223
 Position (Angstrom):   -0.282736133569    2.849670473125    2.914273569306
 Density of all electrons:  0.2492037804E+00
 Density of Alpha electrons:  0.1246018902E+00
 Density of Beta electrons:  0.1246018902E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.5893272221E-01
 G(r) in X,Y,Z:  0.1851356370E-01  0.1292109004E-01  0.2749806847E-01
 Hamiltonian kinetic energy K(r):  0.2152919552E+00
 Potential energy density V(r): -0.2742246774E+00
 Energy density E(r) or H(r): -0.2152919552E+00
 Laplacian of electron density: -0.6254369319E+00
 Electron localization function (ELF):  0.9585227269E+00
 Localized orbital locator (LOL):  0.8278254431E+00
 Local information entropy:  0.3984337257E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2492037804E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1781125171E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8338464101E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6446150114E-02
 Wavefunction value for orbital         1 :  0.7062167488E-07
 Average local ionization energy (ALIE):  0.5794384156E+00
 Delta-g (under promolecular approximation):  0.3135942591E+00
 Delta-g (under Hirshfeld partition):  0.4684951438E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5280291493E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1710362808E-15 -0.4004771775E-17  0.1655009205E-15
 Norm of gradient is:  0.2380336158E-15
 
 Components of Laplacian in x/y/z are:
 -0.1611504641E+00  0.7338020558E-02 -0.4716244883E+00
 Total: -0.6254369319E+00
 
 Hessian matrix:
 -0.1611504641E+00 -0.3955513848E+00  0.9417536428E-03
 -0.3955513848E+00  0.7338020558E-02 -0.8434550925E-02
  0.9417536428E-03 -0.8434550925E-02 -0.4716244883E+00
 Eigenvalues of Hessian: -0.4831543446E+00 -0.4698633408E+00  0.3275807535E+00
 Eigenvectors(columns) of Hessian:
  0.7198810417E+00 -0.2932678672E+00 -0.6290987553E+00
  0.5869109904E+00 -0.2266731911E+00  0.7772739246E+00
  0.3705492885E+00  0.9287697360E+00 -0.8944401475E-02
 Determinant of Hessian:  0.7436624086E-01
 Ellipticity of electron density:    0.028287
 eta index:    1.474917
 
 ----------------   CP   220,     Type (3,-1)   ----------------
 Connected atoms:     6(C )   --     5(C )
 Position (Bohr):        4.224381968654    3.136426925758   -0.773149854411
 Position (Angstrom):    2.235446667961    1.659725652774   -0.409133283567
 Density of all electrons:  0.2894362892E+00
 Density of Alpha electrons:  0.1447181446E+00
 Density of Beta electrons:  0.1447181446E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8897938425E-01
 G(r) in X,Y,Z:  0.3521837779E-01  0.1427101948E-01  0.3948998699E-01
 Hamiltonian kinetic energy K(r):  0.2875216991E+00
 Potential energy density V(r): -0.3765010834E+00
 Energy density E(r) or H(r): -0.2875216991E+00
 Laplacian of electron density: -0.7941692594E+00
 Electron localization function (ELF):  0.9434931162E+00
 Localized orbital locator (LOL):  0.8034069757E+00
 Local information entropy:  0.4535809476E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2894362892E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2040903840E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2351854827E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1188395268E-01
 Wavefunction value for orbital         1 : -0.2459401476E-06
 Average local ionization energy (ALIE):  0.6750226439E+00
 Delta-g (under promolecular approximation):  0.3638842915E+00
 Delta-g (under Hirshfeld partition):  0.5302987270E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6148233355E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.6385950796E-16  0.1544988096E-16 -0.6993104013E-16
 Norm of gradient is:  0.9595356143E-16
 
 Components of Laplacian in x/y/z are:
 -0.5330707264E+00  0.9031677852E-01 -0.3514153115E+00
 Total: -0.7941692594E+00
 
 Hessian matrix:
 -0.5330707264E+00  0.1897259630E+00  0.6416341582E-01
  0.1897259630E+00  0.9031677852E-01  0.3425523280E+00
  0.6416341582E-01  0.3425523280E+00 -0.3514153115E+00
 Eigenvalues of Hessian: -0.5975631079E+00 -0.5192042211E+00  0.3225980696E+00
 Eigenvectors(columns) of Hessian:
  0.8490510191E+00 -0.4779970526E+00 -0.2250137431E+00
 -0.4038177067E+00 -0.3125465864E+00 -0.8597940981E+00
  0.3406517675E+00  0.8208735890E+00 -0.4583916713E+00
 Determinant of Hessian:  0.1000884022E+00
 Ellipticity of electron density:    0.150921
 eta index:    1.852346
 
 ----------------   CP   221,     Type (3,+1)   ----------------
 Position (Bohr):       -7.363636330215    4.803716401100   -0.644999399984
 Position (Angstrom):   -3.896668535327    2.542017247103   -0.341318983517
 Density of all electrons:  0.8905540304E-03
 Density of Alpha electrons:  0.4452770152E-03
 Density of Beta electrons:  0.4452770152E-03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.5580779675E-03
 G(r) in X,Y,Z:  0.1281875671E-03  0.2991295880E-03  0.1307608125E-03
 Hamiltonian kinetic energy K(r): -0.2193077437E-03
 Potential energy density V(r): -0.3387702239E-03
 Energy density E(r) or H(r):  0.2193077437E-03
 Laplacian of electron density:  0.3109542845E-02
 Electron localization function (ELF):  0.1732881887E-02
 Localized orbital locator (LOL):  0.4068509719E-01
 Local information entropy:  0.2486880765E-04
 Reduced density gradient (RDG):  0.1232407467E-14
 Reduced density gradient with promolecular approximation:  0.6435982612E+00
 Sign(lambda2)*rho:  0.8905540304E-03
 Sign(lambda2)*rho with promolecular approximation:  0.1773398881E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4892955169E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2806949887E-04
 Wavefunction value for orbital         1 :  0.1223428198E-05
 Average local ionization energy (ALIE):  0.4592015168E+00
 Delta-g (under promolecular approximation):  0.2025965315E-02
 Delta-g (under Hirshfeld partition):  0.1641380139E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4710530631E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3184843882E-18 -0.2041349403E-18 -0.5590417452E-18
 Norm of gradient is:  0.6750044831E-18
 
 Components of Laplacian in x/y/z are:
  0.5322553395E-03  0.2006864014E-02  0.5704234916E-03
 Total:  0.3109542845E-02
 
 Hessian matrix:
  0.5322553395E-03  0.4440048774E-03 -0.9431756048E-03
  0.4440048774E-03  0.2006864014E-02 -0.6400348950E-03
 -0.9431756048E-03 -0.6400348950E-03  0.5704234916E-03
 Eigenvalues of Hessian: -0.4001988826E-03  0.9456707424E-03  0.2564070985E-02
 Eigenvectors(columns) of Hessian:
  0.6949397972E+00  0.6090067659E+00  0.3823211180E+00
  0.6229239990E-01 -0.5806786184E+00  0.8117462652E+00
  0.7163646663E+00 -0.5402990850E+00 -0.4414731743E+00
 Determinant of Hessian: -0.9703890088E-09
 Ellipticity of electron density:   -1.423191
 eta index:    0.156079
 
 ----------------   CP   222,     Type (3,-1)   ----------------
 Connected atoms:    81(H )   --    71(C )
 Position (Bohr):       -2.394166245848    6.234998723550    6.338714318895
 Position (Angstrom):   -1.266938216416    3.299419234512    3.354303163984
 Density of all electrons:  0.2782535924E+00
 Density of Alpha electrons:  0.1391267962E+00
 Density of Beta electrons:  0.1391267962E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4104378876E-01
 G(r) in X,Y,Z:  0.1036343892E-01  0.1757540381E-01  0.1310494603E-01
 Hamiltonian kinetic energy K(r):  0.2784946373E+00
 Potential energy density V(r): -0.3195384261E+00
 Energy density E(r) or H(r): -0.2784946373E+00
 Laplacian of electron density: -0.9498033943E+00
 Electron localization function (ELF):  0.9856726431E+00
 Localized orbital locator (LOL):  0.8924313525E+00
 Local information entropy:  0.4383791829E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2782535924E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1797667389E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1957290607E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8208435616E-02
 Wavefunction value for orbital         1 :  0.3454874137E-06
 Average local ionization energy (ALIE):  0.5416991803E+00
 Delta-g (under promolecular approximation):  0.2931615887E+00
 Delta-g (under Hirshfeld partition):  0.5125123927E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4761650908E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.5101298276E-15  0.1353939815E-16  0.1706534219E-15
 Norm of gradient is:  0.5380876757E-15
 
 Components of Laplacian in x/y/z are:
 -0.2568953572E-01 -0.6917460008E+00 -0.2323678579E+00
 Total: -0.9498033943E+00
 
 Hessian matrix:
 -0.2568953572E-01  0.1630545772E+00 -0.5881683660E+00
  0.1630545772E+00 -0.6917460008E+00 -0.1350681828E+00
 -0.5881683660E+00 -0.1350681828E+00 -0.2323678579E+00
 Eigenvalues of Hessian: -0.7297299857E+00 -0.7256623090E+00  0.5055889004E+00
 Eigenvectors(columns) of Hessian:
  0.3592134446E+00  0.5495763497E+00 -0.7542755048E+00
 -0.9165294843E+00  0.3600726340E+00 -0.1741304185E+00
  0.1758960080E+00  0.7538657268E+00  0.6330458595E+00
 Determinant of Hessian:  0.2677283058E+00
 Ellipticity of electron density:    0.005605
 eta index:    1.443327
 
 ----------------   CP   223,     Type (3,-1)   ----------------
 Connected atoms:    54(H )   --    32(O )
 Position (Bohr):       -8.431789029642    5.322926551319    0.333124355345
 Position (Angstrom):   -4.461910601628    2.816771426268    0.176281817245
 Density of all electrons:  0.1266266635E-02
 Density of Alpha electrons:  0.6331333175E-03
 Density of Beta electrons:  0.6331333175E-03
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8405483069E-03
 G(r) in X,Y,Z:  0.4496697603E-04  0.7220669587E-03  0.7351437209E-04
 Hamiltonian kinetic energy K(r): -0.2837533595E-03
 Potential energy density V(r): -0.5567949473E-03
 Energy density E(r) or H(r):  0.2837533595E-03
 Laplacian of electron density:  0.4497206666E-02
 Electron localization function (ELF):  0.2496916390E-02
 Localized orbital locator (LOL):  0.4818730905E-01
 Local information entropy:  0.3441632593E-04
 Reduced density gradient (RDG):  0.3993447788E-14
 Reduced density gradient with promolecular approximation:  0.1544339693E+01
 Sign(lambda2)*rho: -0.1266266635E-02
 Sign(lambda2)*rho with promolecular approximation: -0.2069001921E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2306744597E-07
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.3587030492E-04
 Wavefunction value for orbital         1 :  0.9615310986E-07
 Average local ionization energy (ALIE):  0.4747106164E+00
 Delta-g (under promolecular approximation):  0.1860207302E-02
 Delta-g (under Hirshfeld partition):  0.1809929334E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4405401776E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3434718601E-18  0.3070070917E-17 -0.1234974037E-17
 Norm of gradient is:  0.3326930902E-17
 
 Components of Laplacian in x/y/z are:
 -0.6269639792E-03  0.5501879863E-02 -0.3777092184E-03
 Total:  0.4497206666E-02
 
 Hessian matrix:
 -0.6269639792E-03  0.9958543773E-03 -0.2629518035E-03
  0.9958543773E-03  0.5501879863E-02 -0.1569648002E-02
 -0.2629518035E-03 -0.1569648002E-02 -0.3777092184E-03
 Eigenvalues of Hessian: -0.7933427481E-03 -0.7629073404E-03  0.6053456754E-02
 Eigenvectors(columns) of Hessian:
 -0.8560545264E+00  0.4939178590E+00  0.1523673077E+00
  0.6551394190E-02 -0.2843877717E+00  0.9586869534E+00
 -0.5168440065E+00 -0.8216865241E+00 -0.2402155886E+00
 Determinant of Hessian:  0.3663836577E-08
 Ellipticity of electron density:    0.039894
 eta index:    0.131056
 
 ----------------   CP   224,     Type (3,-1)   ----------------
 Connected atoms:    35(O )   --    28(S )
 Position (Bohr):        7.261189538981    4.094691829362    2.584365846400
 Position (Angstrom):    3.842456028076    2.166817601769    1.367587510551
 Density of all electrons:  0.2757458810E+00
 Density of Alpha electrons:  0.1378729405E+00
 Density of Beta electrons:  0.1378729405E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4447955195E+00
 G(r) in X,Y,Z:  0.7298297667E-01  0.1804501725E+00  0.1913623704E+00
 Hamiltonian kinetic energy K(r):  0.3356103106E+00
 Potential energy density V(r): -0.7804058302E+00
 Energy density E(r) or H(r): -0.3356103106E+00
 Laplacian of electron density:  0.4367408356E+00
 Electron localization function (ELF):  0.3624995380E+00
 Localized orbital locator (LOL):  0.4299038580E+00
 Local information entropy:  0.4349572614E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2757458810E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3317464813E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1337938709E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.3982181425E-02
 Wavefunction value for orbital         1 :  0.7634172220E-07
 Average local ionization energy (ALIE):  0.1505862712E+01
 Delta-g (under promolecular approximation):  0.2648809475E+00
 Delta-g (under Hirshfeld partition):  0.3422470879E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6247181847E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1150702729E-15 -0.2182498973E-15  0.2690176640E-15
 Norm of gradient is:  0.3650269702E-15
 
 Components of Laplacian in x/y/z are:
 -0.4643304042E+00  0.4013009686E+00  0.4997702712E+00
 Total:  0.4367408356E+00
 
 Hessian matrix:
 -0.4643304042E+00  0.3871581591E-01 -0.2946380384E-01
  0.3871581591E-01  0.4013009686E+00 -0.9195757043E+00
 -0.2946380384E-01 -0.9195757043E+00  0.4997702712E+00
 Eigenvalues of Hessian: -0.4761533141E+00 -0.4597894352E+00  0.1372683585E+01
 Eigenvectors(columns) of Hessian:
  0.5949480742E+00 -0.8033392639E+00 -0.2613075089E-01
 -0.5938717259E+00 -0.4174454993E+00 -0.6877903956E+00
 -0.5416208658E+00 -0.4247178855E+00  0.7254388710E+00
 Determinant of Hessian:  0.3005219788E+00
 Ellipticity of electron density:    0.035590
 eta index:    0.346878
 
 ----------------   CP   225,     Type (3,-1)   ----------------
 Connected atoms:     7(C )   --     2(C )
 Position (Bohr):       -1.408622477166    3.696812751040   -3.385810935056
 Position (Angstrom):   -0.745410913682    1.956269060826   -1.791693987258
 Density of all electrons:  0.2970366873E+00
 Density of Alpha electrons:  0.1485183436E+00
 Density of Beta electrons:  0.1485183436E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.8885209782E-01
 G(r) in X,Y,Z:  0.1304061443E-01  0.3374794223E-01  0.4206354115E-01
 Hamiltonian kinetic energy K(r):  0.2988280273E+00
 Potential energy density V(r): -0.3876801251E+00
 Energy density E(r) or H(r): -0.2988280273E+00
 Laplacian of electron density: -0.8399037179E+00
 Electron localization function (ELF):  0.9480679912E+00
 Localized orbital locator (LOL):  0.8103610642E+00
 Local information entropy:  0.4638604584E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2970366873E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2068505653E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1955414691E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1283571249E-01
 Wavefunction value for orbital         1 : -0.3637891633E-06
 Average local ionization energy (ALIE):  0.6689679463E+00
 Delta-g (under promolecular approximation):  0.3703745183E+00
 Delta-g (under Hirshfeld partition):  0.5437496848E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6011678131E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1542819691E-15  0.1295621596E-15 -0.9497611031E-16
 Norm of gradient is:  0.2227324420E-15
 
 Components of Laplacian in x/y/z are:
  0.1617783140E+00 -0.6146295866E+00 -0.3870524453E+00
 Total: -0.8399037179E+00
 
 Hessian matrix:
  0.1617783140E+00  0.6471442944E-01  0.3428378403E+00
  0.6471442944E-01 -0.6146295866E+00 -0.1616591483E-02
  0.3428378403E+00 -0.1616591483E-02 -0.3870524453E+00
 Eigenvalues of Hessian: -0.6293148091E+00 -0.5406087574E+00  0.3300198486E+00
 Eigenvectors(columns) of Hessian:
  0.2043910995E+00 -0.3836786557E+00 -0.9005636944E+00
 -0.9332313704E+00 -0.3540669012E+00 -0.6095767967E-01
 -0.2954716361E+00  0.8528934978E+00 -0.4304290809E+00
 Determinant of Hessian:  0.1122770747E+00
 Ellipticity of electron density:    0.164085
 eta index:    1.906900
 
 ----------------   CP   226,     Type (3,-1)   ----------------
 Connected atoms:    79(H )   --     4(C )
 Position (Bohr):        2.500141350356    5.018080491282    2.508877309545
 Position (Angstrom):    1.323017826645    2.655453838463    1.327640697163
 Density of all electrons:  0.9570471488E-02
 Density of Alpha electrons:  0.4785235744E-02
 Density of Beta electrons:  0.4785235744E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.5897555780E-02
 G(r) in X,Y,Z:  0.7643569120E-03  0.4873470010E-03  0.4645851867E-02
 Hamiltonian kinetic energy K(r): -0.9373558219E-03
 Potential energy density V(r): -0.4960199958E-02
 Energy density E(r) or H(r):  0.9373558219E-03
 Laplacian of electron density:  0.2733964641E-01
 Electron localization function (ELF):  0.4211275778E-01
 Localized orbital locator (LOL):  0.1735755592E+00
 Local information entropy:  0.2191080733E-03
 Reduced density gradient (RDG):  0.8336192287E-15
 Reduced density gradient with promolecular approximation:  0.1429480739E+00
 Sign(lambda2)*rho: -0.9570471488E-02
 Sign(lambda2)*rho with promolecular approximation: -0.1615922388E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2652431142E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.3542100667E-03
 Wavefunction value for orbital         1 :  0.1170624880E-06
 Average local ionization energy (ALIE):  0.4806435982E+00
 Delta-g (under promolecular approximation):  0.2069604222E-01
 Delta-g (under Hirshfeld partition):  0.1831625088E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5433256731E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4336808690E-17  0.3252606517E-18 -0.9107298249E-17
 Norm of gradient is:  0.1009240237E-16
 
 Components of Laplacian in x/y/z are:
 -0.1935514158E-02 -0.4456162543E-02  0.3373132311E-01
 Total:  0.2733964641E-01
 
 Hessian matrix:
 -0.1935514158E-02  0.9592775943E-03 -0.1334090043E-01
  0.9592775943E-03 -0.4456162543E-02 -0.7801583855E-02
 -0.1334090043E-01 -0.7801583855E-02  0.3373132311E-01
 Eigenvalues of Hessian: -0.7645836890E-02 -0.4535467684E-02  0.3952095098E-01
 Eigenvectors(columns) of Hessian:
  0.6962357955E+00  0.6496296960E+00 -0.3053473026E+00
  0.6303766916E+00 -0.7568161019E+00 -0.1727848795E+00
  0.3433379440E+00  0.7218480442E-01  0.9364338792E+00
 Determinant of Hessian:  0.1370485649E-05
 Ellipticity of electron density:    0.685788
 eta index:    0.193463
 
 ----------------   CP   227,     Type (3,+1)   ----------------
 Position (Bohr):        2.163754344817    3.981742980407   -1.492885200714
 Position (Angstrom):    1.145009489269    2.107047644904   -0.790000826712
 Density of all electrons:  0.2232880245E-01
 Density of Alpha electrons:  0.1116440122E-01
 Density of Beta electrons:  0.1116440122E-01
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3047918438E-01
 G(r) in X,Y,Z:  0.1125523696E-01  0.1287622150E-01  0.6347725926E-02
 Hamiltonian kinetic energy K(r): -0.4361831078E-02
 Potential energy density V(r): -0.2611735330E-01
 Energy density E(r) or H(r):  0.4361831078E-02
 Laplacian of electron density:  0.1393640618E+00
 Electron localization function (ELF):  0.2704920738E-01
 Localized orbital locator (LOL):  0.1429489559E+00
 Local information entropy:  0.4711214974E-03
 Reduced density gradient (RDG):  0.3254727354E-15
 Reduced density gradient with promolecular approximation:  0.1854200589E-01
 Sign(lambda2)*rho:  0.2232880245E-01
 Sign(lambda2)*rho with promolecular approximation:  0.5446351897E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2076454783E-04
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2324389243E-02
 Wavefunction value for orbital         1 : -0.2081891042E-06
 Average local ionization energy (ALIE):  0.8021055351E+00
 Delta-g (under promolecular approximation):  0.8386518197E-01
 Delta-g (under Hirshfeld partition):  0.4532735066E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5885516508E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3455894425E-17 -0.3476223216E-17  0.1209224236E-16
 Norm of gradient is:  0.1304797529E-16
 
 Components of Laplacian in x/y/z are:
  0.5586385615E-01  0.7075060000E-01  0.1274960569E-01
 Total:  0.1393640618E+00
 
 Hessian matrix:
  0.5586385615E-01 -0.1312270293E-01  0.3152214097E-01
 -0.1312270293E-01  0.7075060000E-01  0.2794258825E-01
  0.3152214097E-01  0.2794258825E-01  0.1274960569E-01
 Eigenvalues of Hessian: -0.1497727101E-01  0.7230723183E-01  0.8203410103E-01
 Eigenvectors(columns) of Hessian:
 -0.4341709363E+00  0.9002518535E+00 -0.3228309744E-01
 -0.3385562327E+00 -0.1298584299E+00  0.9319423080E+00
  0.8347905578E+00  0.4155519083E+00  0.3611666321E+00
 Determinant of Hessian: -0.8884006082E-04
 Ellipticity of electron density:   -1.207134
 eta index:    0.182574
 
 ----------------   CP   228,     Type (3,-1)   ----------------
 Connected atoms:     5(C )   --    28(S )
 Position (Bohr):        5.807817881272    4.550283054820    0.732582254201
 Position (Angstrom):    3.073364867844    2.407906095769    0.387665834035
 Density of all electrons:  0.1955495161E+00
 Density of Alpha electrons:  0.9777475803E-01
 Density of Beta electrons:  0.9777475803E-01
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4027245089E-01
 G(r) in X,Y,Z:  0.1310539726E-01  0.1293345099E-01  0.1423360264E-01
 Hamiltonian kinetic energy K(r):  0.1382427450E+00
 Potential energy density V(r): -0.1785151958E+00
 Energy density E(r) or H(r): -0.1382427450E+00
 Laplacian of electron density: -0.3918811763E+00
 Electron localization function (ELF):  0.9566178959E+00
 Localized orbital locator (LOL):  0.8244694219E+00
 Local information entropy:  0.3226948435E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.1955495161E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1265109935E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1807204902E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.4206024424E-02
 Wavefunction value for orbital         1 :  0.3193745945E-07
 Average local ionization energy (ALIE):  0.6219546259E+00
 Delta-g (under promolecular approximation):  0.2490745611E+00
 Delta-g (under Hirshfeld partition):  0.3635799181E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5967450192E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1150609556E-16 -0.1099923104E-15  0.3675445365E-16
 Norm of gradient is:  0.1165400723E-15
 
 Components of Laplacian in x/y/z are:
  0.5978211901E-01 -0.3158792133E+00 -0.1357840820E+00
 Total: -0.3918811763E+00
 
 Hessian matrix:
  0.5978211901E-01  0.8153350269E-01  0.2667213861E+00
  0.8153350269E-01 -0.3158792133E+00  0.5228807259E-01
  0.2667213861E+00  0.5228807259E-01 -0.1357840820E+00
 Eigenvalues of Hessian: -0.3333421957E+00 -0.3208210083E+00  0.2622820277E+00
 Eigenvectors(columns) of Hessian:
  0.3098280149E+00 -0.4992245031E+00 -0.8091856998E+00
 -0.9353367980E+00 -0.3128641814E+00 -0.1651092919E+00
 -0.1707386174E+00  0.8080166456E+00 -0.5638771365E+00
 Determinant of Hessian:  0.2804927392E-01
 Ellipticity of electron density:    0.039029
 eta index:    1.270930
 
 ----------------   CP   229,     Type (3,-1)   ----------------
 Connected atoms:    71(C )   --    82(H )
 Position (Bohr):       -1.936349690361    6.561227400180    4.292188529793
 Position (Angstrom):   -1.024672128478    3.472052015728    2.271328354866
 Density of all electrons:  0.2784433675E+00
 Density of Alpha electrons:  0.1392216837E+00
 Density of Beta electrons:  0.1392216837E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4131099813E-01
 G(r) in X,Y,Z:  0.1657861997E-01  0.1821791452E-01  0.6514463645E-02
 Hamiltonian kinetic energy K(r):  0.2791318023E+00
 Potential energy density V(r): -0.3204428004E+00
 Energy density E(r) or H(r): -0.2791318023E+00
 Laplacian of electron density: -0.9512832166E+00
 Electron localization function (ELF):  0.9855207102E+00
 Localized orbital locator (LOL):  0.8919164032E+00
 Local information entropy:  0.4386379469E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2784433675E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1800154444E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3235835071E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9373521712E-02
 Wavefunction value for orbital         1 :  0.5145065071E-07
 Average local ionization energy (ALIE):  0.5417501532E+00
 Delta-g (under promolecular approximation):  0.2943235537E+00
 Delta-g (under Hirshfeld partition):  0.5134583097E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5135116501E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1198043401E-16 -0.9000762680E-16 -0.5536207343E-17
 Norm of gradient is:  0.9097006800E-16
 
 Components of Laplacian in x/y/z are:
 -0.5212591212E+00 -0.7240025064E+00  0.2939784111E+00
 Total: -0.9512832166E+00
 
 Hessian matrix:
 -0.5212591212E+00 -0.3642233436E-01  0.4608771905E+00
 -0.3642233436E-01 -0.7240025064E+00 -0.8354856193E-01
  0.4608771905E+00 -0.8354856193E-01  0.2939784111E+00
 Eigenvalues of Hessian: -0.7312663814E+00 -0.7283890646E+00  0.5083722295E+00
 Eigenvectors(columns) of Hessian:
  0.3617969315E+00 -0.8374489502E+00  0.4096122999E+00
 -0.9018563194E+00 -0.4256948758E+00 -0.7374992837E-01
 -0.2361316572E+00  0.3427289433E+00  0.9092737277E+00
 Determinant of Hessian:  0.2707826560E+00
 Ellipticity of electron density:    0.003950
 eta index:    1.438447
 
 ----------------   CP   230,     Type (3,-1)   ----------------
 Connected atoms:     7(C )   --     8(C )
 Position (Bohr):       -3.500337875709    4.640998651758   -3.823263319080
 Position (Angstrom):   -1.852299034286    2.455910722342   -2.023183819739
 Density of all electrons:  0.3307886157E+00
 Density of Alpha electrons:  0.1653943079E+00
 Density of Beta electrons:  0.1653943079E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1165442221E+00
 G(r) in X,Y,Z:  0.2929447675E-01  0.2537193044E-01  0.6187781496E-01
 Hamiltonian kinetic energy K(r):  0.3655086286E+00
 Potential energy density V(r): -0.4820528508E+00
 Energy density E(r) or H(r): -0.3655086286E+00
 Laplacian of electron density: -0.9958576260E+00
 Electron localization function (ELF):  0.9382368441E+00
 Localized orbital locator (LOL):  0.7958301449E+00
 Local information entropy:  0.5090258418E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3307886157E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2269250973E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1986968842E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1139006585E-01
 Wavefunction value for orbital         1 : -0.9368565039E-06
 Average local ionization energy (ALIE):  0.6761535469E+00
 Delta-g (under promolecular approximation):  0.3898013585E+00
 Delta-g (under Hirshfeld partition):  0.5888583608E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5769174678E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2213940836E-15 -0.9367506770E-16 -0.3035766083E-16
 Norm of gradient is:  0.2423054810E-15
 
 Components of Laplacian in x/y/z are:
 -0.2750158095E+00 -0.9710781830E-01 -0.6237339982E+00
 Total: -0.9958576260E+00
 
 Hessian matrix:
 -0.2750158095E+00 -0.4945918324E+00 -0.1040337418E+00
 -0.4945918324E+00 -0.9710781830E-01  0.2510399208E-01
 -0.1040337418E+00  0.2510399208E-01 -0.6237339982E+00
 Eigenvalues of Hessian: -0.7296471254E+00 -0.5905095586E+00  0.3242990580E+00
 Eigenvectors(columns) of Hessian:
 -0.6727208311E+00 -0.3657070742E+00  0.6431990511E+00
 -0.5045315120E+00 -0.4091237504E+00 -0.7603063266E+00
 -0.5411974103E+00  0.8359880936E+00 -0.9071532628E-01
 Determinant of Hessian:  0.1397286602E+00
 Ellipticity of electron density:    0.235623
 eta index:    2.249921
 
 ----------------   CP   231,     Type (3,+1)   ----------------
 Position (Bohr):        0.162474039282    6.001513965036    2.204607535730
 Position (Angstrom):    0.085977558952    3.175864421213    1.166628066893
 Density of all electrons:  0.3475646570E-02
 Density of Alpha electrons:  0.1737823285E-02
 Density of Beta electrons:  0.1737823285E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2591645231E-02
 G(r) in X,Y,Z:  0.9205551906E-03  0.2799404575E-03  0.1391149583E-02
 Hamiltonian kinetic energy K(r): -0.7724757817E-03
 Potential energy density V(r): -0.1819169449E-02
 Energy density E(r) or H(r):  0.7724757817E-03
 Laplacian of electron density:  0.1345648405E-01
 Electron localization function (ELF):  0.7686733957E-02
 Localized orbital locator (LOL):  0.8118007605E-01
 Local information entropy:  0.8703073310E-04
 Reduced density gradient (RDG):  0.5822191875E-15
 Reduced density gradient with promolecular approximation:  0.1452694970E+00
 Sign(lambda2)*rho:  0.3475646570E-02
 Sign(lambda2)*rho with promolecular approximation:  0.8543431807E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.8414793656E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1674303830E-03
 Wavefunction value for orbital         1 : -0.8973863954E-06
 Average local ionization energy (ALIE):  0.5205974030E+00
 Delta-g (under promolecular approximation):  0.1012775310E-01
 Delta-g (under Hirshfeld partition):  0.6710015505E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5285021648E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.9757819552E-18  0.9283481102E-18  0.1409462824E-17
 Norm of gradient is:  0.1949504063E-17
 
 Components of Laplacian in x/y/z are:
  0.4659857748E-02 -0.8807382915E-03  0.9677364595E-02
 Total:  0.1345648405E-01
 
 Hessian matrix:
  0.4659857748E-02 -0.1433425000E-02 -0.4151998264E-02
 -0.1433425000E-02 -0.8807382915E-03 -0.9213400548E-03
 -0.4151998264E-02 -0.9213400548E-03  0.9677364595E-02
 Eigenvalues of Hessian: -0.1616972988E-02  0.3053006121E-02  0.1202045092E-01
 Eigenvectors(columns) of Hessian:
 -0.3423989657E+00  0.8015747859E+00 -0.4901436635E+00
 -0.9178582487E+00 -0.3968319508E+00 -0.7787045601E-02
 -0.2007465656E+00  0.4472161282E+00  0.8716068787E+00
 Determinant of Hessian: -0.5934049974E-07
 Ellipticity of electron density:   -1.529633
 eta index:    0.134518
 
 ----------------   CP   232,     Type (3,-1)   ----------------
 Connected atoms:    28(S )   --    34(O )
 Position (Bohr):        8.175652538974    4.790723259623    1.104564919047
 Position (Angstrom):    4.326369007886    2.535141572735    0.584510583123
 Density of all electrons:  0.2795555938E+00
 Density of Alpha electrons:  0.1397777969E+00
 Density of Beta electrons:  0.1397777969E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4621299256E+00
 G(r) in X,Y,Z:  0.2246550057E+00  0.7657532312E-01  0.1608995967E+00
 Hamiltonian kinetic energy K(r):  0.3403485375E+00
 Potential energy density V(r): -0.8024784631E+00
 Energy density E(r) or H(r): -0.3403485375E+00
 Laplacian of electron density:  0.4871255522E+00
 Electron localization function (ELF):  0.3554300837E+00
 Localized orbital locator (LOL):  0.4261428863E+00
 Local information entropy:  0.4401539502E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2795555938E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3365695446E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1016555406E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.4063317827E-02
 Wavefunction value for orbital         1 : -0.6867514770E-07
 Average local ionization energy (ALIE):  0.1524870537E+01
 Delta-g (under promolecular approximation):  0.2718018238E+00
 Delta-g (under Hirshfeld partition):  0.3523254786E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6112715058E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.3266175985E-15 -0.1122623587E-15  0.3457554609E-15
 Norm of gradient is:  0.4887010657E-15
 
 Components of Laplacian in x/y/z are:
  0.7376835459E+00 -0.4739698223E+00  0.2234118286E+00
 Total:  0.4871255522E+00
 
 Hessian matrix:
  0.7376835459E+00 -0.9727193516E-01 -0.9125154749E+00
 -0.9727193516E-01 -0.4739698223E+00  0.7743395047E-01
 -0.9125154749E+00  0.7743395047E-01  0.2234118286E+00
 Eigenvalues of Hessian: -0.4826536182E+00 -0.4669065045E+00  0.1436685675E+01
 Eigenvectors(columns) of Hessian:
  0.6690999988E-01  0.6022355316E+00  0.7955095325E+00
 -0.9787539429E+00  0.1944908714E+00 -0.6491548499E-01
  0.1938137538E+00  0.7742645965E+00 -0.6024537853E+00
 Determinant of Hessian:  0.3237630270E+00
 Ellipticity of electron density:    0.033726
 eta index:    0.335949
 
 ----------------   CP   233,     Type (3,-1)   ----------------
 Connected atoms:     2(C )   --     3(C )
 Position (Bohr):        0.134685930682    4.937491612401   -2.158667298961
 Position (Angstrom):    0.071272725146    2.612808040308   -1.142317540532
 Density of all electrons:  0.2993733173E+00
 Density of Alpha electrons:  0.1496866586E+00
 Density of Beta electrons:  0.1496866586E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.9171431908E-01
 G(r) in X,Y,Z:  0.3491915641E-01  0.1621654743E-01  0.4057861525E-01
 Hamiltonian kinetic energy K(r):  0.3030542154E+00
 Potential energy density V(r): -0.3947685345E+00
 Energy density E(r) or H(r): -0.3030542154E+00
 Laplacian of electron density: -0.8453595854E+00
 Electron localization function (ELF):  0.9462013066E+00
 Localized orbital locator (LOL):  0.8074790467E+00
 Local information entropy:  0.4670124117E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2993733173E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2097809322E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5667441389E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1247980110E-01
 Wavefunction value for orbital         1 :  0.1114550318E-06
 Average local ionization energy (ALIE):  0.6615888680E+00
 Delta-g (under promolecular approximation):  0.3761223137E+00
 Delta-g (under Hirshfeld partition):  0.5468137472E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6029194453E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.6321915105E-16  0.2587262137E-16 -0.1666198511E-15
 Norm of gradient is:  0.1800783950E-15
 
 Components of Laplacian in x/y/z are:
 -0.5550314560E+00  0.6221738921E-01 -0.3525455186E+00
 Total: -0.8453595854E+00
 
 Hessian matrix:
 -0.5550314560E+00  0.2097152272E+00  0.8871397725E-01
  0.2097152272E+00  0.6221738921E-01  0.3624399683E+00
  0.8871397725E-01  0.3624399683E+00 -0.3525455186E+00
 Eigenvalues of Hessian: -0.6249396501E+00 -0.5505530027E+00  0.3301330674E+00
 Eigenvectors(columns) of Hessian:
 -0.8863577158E+00 -0.3912766234E+00  0.2475330354E+00
  0.3965589535E+00 -0.3656099928E+00  0.8420631387E+00
 -0.2389790703E+00  0.8445306017E+00  0.4792254864E+00
 Determinant of Hessian:  0.1135863758E+00
 Ellipticity of electron density:    0.135113
 eta index:    1.892993
 
 ----------------   CP   234,     Type (3,-1)   ----------------
 Connected atoms:     5(C )   --     4(C )
 Position (Bohr):        3.635222428896    5.314510350003   -0.224337057385
 Position (Angstrom):    1.923676865935    2.812317764330   -0.118714058329
 Density of all electrons:  0.3320374502E+00
 Density of Alpha electrons:  0.1660187251E+00
 Density of Beta electrons:  0.1660187251E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1258573843E+00
 G(r) in X,Y,Z:  0.3470895993E-01  0.2511984132E-01  0.6602858305E-01
 Hamiltonian kinetic energy K(r):  0.3718842681E+00
 Potential energy density V(r): -0.4977416524E+00
 Energy density E(r) or H(r): -0.3718842681E+00
 Laplacian of electron density: -0.9841075353E+00
 Electron localization function (ELF):  0.9295312855E+00
 Localized orbital locator (LOL):  0.7841193043E+00
 Local information entropy:  0.5106824973E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3320374502E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2304677183E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1649369968E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1215515683E-01
 Wavefunction value for orbital         1 : -0.7219396878E-07
 Average local ionization energy (ALIE):  0.6807975391E+00
 Delta-g (under promolecular approximation):  0.3907371533E+00
 Delta-g (under Hirshfeld partition):  0.5868378400E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5970661752E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.9324138683E-16  0.8332093696E-16 -0.3783865582E-16
 Norm of gradient is:  0.1306449334E-15
 
 Components of Laplacian in x/y/z are:
 -0.2512149159E+00 -0.1089989232E+00 -0.6238936962E+00
 Total: -0.9841075353E+00
 
 Hessian matrix:
 -0.2512149159E+00 -0.4874351686E+00 -0.1736988162E-01
 -0.4874351686E+00 -0.1089989232E+00 -0.7223542555E-01
 -0.1736988162E-01 -0.7223542555E-01 -0.6238936962E+00
 Eigenvalues of Hessian: -0.7140052140E+00 -0.5845939239E+00  0.3144916026E+00
 Eigenvectors(columns) of Hessian:
  0.6086060229E+00  0.4533062268E+00  0.6512389528E+00
  0.5577222607E+00  0.3394074878E+00 -0.7574618387E+00
  0.5643975450E+00 -0.8242062982E+00  0.4625353232E-01
 Determinant of Hessian:  0.1312697729E+00
 Ellipticity of electron density:    0.221370
 eta index:    2.270347
 
 ----------------   CP   235,     Type (3,-1)   ----------------
 Connected atoms:    42(H )   --     8(C )
 Position (Bohr):       -5.530501010165    5.489752177046   -4.261202521251
 Position (Angstrom):   -2.926615099455    2.905051745598   -2.254931265289
 Density of all electrons:  0.2885212379E+00
 Density of Alpha electrons:  0.1442606189E+00
 Density of Beta electrons:  0.1442606189E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3392108905E-01
 G(r) in X,Y,Z:  0.5367605700E-02  0.1502272814E-01  0.1353075521E-01
 Hamiltonian kinetic energy K(r):  0.2957885804E+00
 Potential energy density V(r): -0.3297096694E+00
 Energy density E(r) or H(r): -0.2957885804E+00
 Laplacian of electron density: -0.1047469965E+01
 Electron localization function (ELF):  0.9912771004E+00
 Localized orbital locator (LOL):  0.9142616014E+00
 Local information entropy:  0.4523405139E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2885212379E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1808469812E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.7957923717E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9385203073E-02
 Wavefunction value for orbital         1 :  0.3271653169E-06
 Average local ionization energy (ALIE):  0.5817963118E+00
 Delta-g (under promolecular approximation):  0.3176587669E+00
 Delta-g (under Hirshfeld partition):  0.5452563884E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5163570803E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.6458592341E-15 -0.1831827333E-15 -0.2130118456E-15
 Norm of gradient is:  0.7043181884E-15
 
 Components of Laplacian in x/y/z are:
  0.3039608960E+00 -0.7918597354E+00 -0.5595711258E+00
 Total: -0.1047469965E+01
 
 Hessian matrix:
  0.3039608960E+00  0.1011966911E+00  0.5109144468E+00
  0.1011966911E+00 -0.7918597354E+00  0.4446708853E-01
  0.5109144468E+00  0.4446708853E-01 -0.5595711258E+00
 Eigenvalues of Hessian: -0.8019435411E+00 -0.7957424779E+00  0.5502160538E+00
 Eigenvectors(columns) of Hessian:
 -0.2359274866E+00 -0.3564277293E+00  0.9040450735E+00
  0.9141635115E+00 -0.3969510572E+00  0.8206663340E-01
  0.3296108239E+00  0.8458067935E+00  0.4194848899E+00
 Determinant of Hessian:  0.3511151700E+00
 Ellipticity of electron density:    0.007793
 eta index:    1.457507
 
 ----------------   CP   236,     Type (3,-1)   ----------------
 Connected atoms:    71(C )   --    72(C )
 Position (Bohr):       -0.736319110992    7.707823897762    5.835305218068
 Position (Angstrom):   -0.389643293489    4.078804752349    3.087910540065
 Density of all electrons:  0.2441803026E+00
 Density of Alpha electrons:  0.1220901513E+00
 Density of Beta electrons:  0.1220901513E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.5823745610E-01
 G(r) in X,Y,Z:  0.2177214343E-01  0.1092987839E-01  0.2553543428E-01
 Hamiltonian kinetic energy K(r):  0.2076827016E+00
 Potential energy density V(r): -0.2659201577E+00
 Energy density E(r) or H(r): -0.2076827016E+00
 Laplacian of electron density: -0.5977809822E+00
 Electron localization function (ELF):  0.9567315422E+00
 Localized orbital locator (LOL):  0.8246566630E+00
 Local information entropy:  0.3914555501E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2441803026E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1768340068E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5540651074E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.4906369066E-02
 Wavefunction value for orbital         1 : -0.5346976162E-08
 Average local ionization energy (ALIE):  0.5652978249E+00
 Delta-g (under promolecular approximation):  0.3294167257E+00
 Delta-g (under Hirshfeld partition):  0.4624632071E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4854967995E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.5777188217E-16 -0.7838442894E-17 -0.1705263670E-15
 Norm of gradient is:  0.1802172950E-15
 
 Components of Laplacian in x/y/z are:
 -0.2967743649E+00  0.1154713029E+00 -0.4164779202E+00
 Total: -0.5977809822E+00
 
 Hessian matrix:
 -0.2967743649E+00  0.3073969674E+00  0.8257609534E-01
  0.3073969674E+00  0.1154713029E+00  0.1545376618E+00
  0.8257609534E-01  0.1545376618E+00 -0.4164779202E+00
 Eigenvalues of Hessian: -0.4607641036E+00 -0.4580975329E+00  0.3210806543E+00
 Eigenvectors(columns) of Hessian:
  0.8862120653E+00 -0.6998351542E-01 -0.4579634079E+00
 -0.4613093935E+00 -0.2243771760E+00 -0.8583988154E+00
 -0.4268276943E-01  0.9719862090E+00 -0.2311298136E+00
 Determinant of Hessian:  0.6777206672E-01
 Ellipticity of electron density:    0.005821
 eta index:    1.435042
 
 ----------------   CP   237,     Type (3,-1)   ----------------
 Connected atoms:    28(S )   --    33(O )
 Position (Bohr):        7.156467361254    5.897096476411    2.184563088743
 Position (Angstrom):    3.787039438147    3.120609065813    1.156021002343
 Density of all electrons:  0.2771552229E+00
 Density of Alpha electrons:  0.1385776115E+00
 Density of Beta electrons:  0.1385776115E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4509603417E+00
 G(r) in X,Y,Z:  0.7785442989E-01  0.2684936582E+00  0.1046122536E+00
 Hamiltonian kinetic energy K(r):  0.3377251198E+00
 Potential energy density V(r): -0.7886854615E+00
 Energy density E(r) or H(r): -0.3377251198E+00
 Laplacian of electron density:  0.4529408878E+00
 Electron localization function (ELF):  0.3600683920E+00
 Localized orbital locator (LOL):  0.4286132059E+00
 Local information entropy:  0.4368809842E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2771552229E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3334508963E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2714137215E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.3783354458E-02
 Wavefunction value for orbital         1 : -0.1025705918E-06
 Average local ionization energy (ALIE):  0.1509600622E+01
 Delta-g (under promolecular approximation):  0.2669382221E+00
 Delta-g (under Hirshfeld partition):  0.3456529171E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.6052442445E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1248119988E-15 -0.2060921952E-15 -0.1154675314E-15
 Norm of gradient is:  0.2671793008E-15
 
 Components of Laplacian in x/y/z are:
 -0.4377179748E+00  0.1112368569E+01 -0.2217097062E+00
 Total:  0.4529408878E+00
 
 Hessian matrix:
 -0.4377179748E+00 -0.2030198087E+00 -0.6854748273E-01
 -0.2030198087E+00  0.1112368569E+01  0.6352018344E+00
 -0.6854748273E-01  0.6352018344E+00 -0.2217097062E+00
 Eigenvalues of Hessian: -0.4826209397E+00 -0.4558936651E+00  0.1391455493E+01
 Eigenvectors(columns) of Hessian:
 -0.5029276210E+00  0.8564844164E+00 -0.1161819801E+00
 -0.3742851551E+00 -0.9464719647E-01  0.9224708835E+00
  0.7790856376E+00  0.5074212773E+00  0.3681700920E+00
 Determinant of Hessian:  0.3061533654E+00
 Ellipticity of electron density:    0.058626
 eta index:    0.346846
 
 ----------------   CP   238,     Type (3,+1)   ----------------
 Position (Bohr):       -1.932376824438    5.780646341366   -2.600419441751
 Position (Angstrom):   -1.022569778370    3.058986308141   -1.376082707364
 Density of all electrons:  0.2342002190E-01
 Density of Alpha electrons:  0.1171001095E-01
 Density of Beta electrons:  0.1171001095E-01
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3218514848E-01
 G(r) in X,Y,Z:  0.1339563912E-01  0.1235904502E-01  0.6430464339E-02
 Hamiltonian kinetic energy K(r): -0.4478597092E-02
 Potential energy density V(r): -0.2770655139E-01
 Energy density E(r) or H(r):  0.4478597092E-02
 Laplacian of electron density:  0.1466549823E+00
 Electron localization function (ELF):  0.2840104629E-01
 Localized orbital locator (LOL):  0.1460469696E+00
 Local information entropy:  0.4917779353E-03
 Reduced density gradient (RDG):  0.1013200485E-14
 Reduced density gradient with promolecular approximation:  0.1152181099E-01
 Sign(lambda2)*rho:  0.2342002190E-01
 Sign(lambda2)*rho with promolecular approximation:  0.5643212416E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3901664822E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1761143273E-02
 Wavefunction value for orbital         1 : -0.7079497782E-06
 Average local ionization energy (ALIE):  0.7969178884E+00
 Delta-g (under promolecular approximation):  0.8827062191E-01
 Delta-g (under Hirshfeld partition):  0.4757146268E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5613427123E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.5708790306E-17 -0.3424723612E-16 -0.2606828598E-16
 Norm of gradient is:  0.4341680554E-16
 
 Components of Laplacian in x/y/z are:
  0.7203316640E-01  0.6339163690E-01  0.1123017898E-01
 Total:  0.1466549823E+00
 
 Hessian matrix:
  0.7203316640E-01 -0.1375205821E-01  0.2988754572E-01
 -0.1375205821E-01  0.6339163690E-01  0.3183867190E-01
  0.2988754572E-01  0.3183867190E-01  0.1123017898E-01
 Eigenvalues of Hessian: -0.1612292717E-01  0.7844854884E-01  0.8432936060E-01
 Eigenvectors(columns) of Hessian:
 -0.3496282122E+00 -0.5363581084E-01 -0.9353519728E+00
 -0.3997486316E+00  0.9114611652E+00  0.9715748018E-01
  0.8473258787E+00  0.4078746673E+00 -0.3401133797E+00
 Determinant of Hessian: -0.1066614821E-03
 Ellipticity of electron density:   -1.205522
 eta index:    0.191190
 
 ----------------   CP   239,     Type (3,-1)   ----------------
 Connected atoms:    82(H )   --    10(C )
 Position (Bohr):       -1.745707867253    7.121231812499    1.601418000186
 Position (Angstrom):   -0.923788820244    3.768393588732    0.847433910828
 Density of all electrons:  0.6432727783E-02
 Density of Alpha electrons:  0.3216363892E-02
 Density of Beta electrons:  0.3216363892E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3915147959E-02
 G(r) in X,Y,Z:  0.3021794274E-03  0.4278385216E-03  0.3185130010E-02
 Hamiltonian kinetic energy K(r): -0.7301095929E-03
 Potential energy density V(r): -0.3185038366E-02
 Energy density E(r) or H(r):  0.7301095929E-03
 Laplacian of electron density:  0.1858103021E-01
 Electron localization function (ELF):  0.2580602592E-01
 Localized orbital locator (LOL):  0.1402819358E+00
 Local information entropy:  0.1526864579E-03
 Reduced density gradient (RDG):  0.5297373895E-15
 Reduced density gradient with promolecular approximation:  0.5624295900E-01
 Sign(lambda2)*rho: -0.6432727783E-02
 Sign(lambda2)*rho with promolecular approximation: -0.1212289828E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3324290489E-07
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1970213384E-03
 Wavefunction value for orbital         1 : -0.3210645292E-06
 Average local ionization energy (ALIE):  0.4738080975E+00
 Delta-g (under promolecular approximation):  0.1667116092E-01
 Delta-g (under Hirshfeld partition):  0.1249278930E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5074563150E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1707618422E-17 -0.1544988096E-17  0.3577867169E-17
 Norm of gradient is:  0.4254889231E-17
 
 Components of Laplacian in x/y/z are:
 -0.3138760316E-02 -0.2127264694E-02  0.2384705522E-01
 Total:  0.1858103021E-01
 
 Hessian matrix:
 -0.3138760316E-02  0.7601891789E-03 -0.4604847879E-02
  0.7601891789E-03 -0.2127264694E-02 -0.6783429048E-02
 -0.4604847879E-02 -0.6783429048E-02  0.2384705522E-01
 Eigenvalues of Hessian: -0.4191224093E-02 -0.3476574724E-02  0.2624882903E-01
 Eigenvectors(columns) of Hessian:
  0.7382115654E+00  0.6561840475E+00 -0.1564166889E+00
  0.6178619346E+00 -0.7507836840E+00 -0.2336032739E+00
  0.2707218397E+00 -0.7580472052E-01  0.9596683437E+00
 Determinant of Hessian:  0.3824744110E-06
 Ellipticity of electron density:    0.205561
 eta index:    0.159673
 
 ----------------   CP   240,     Type (3,-1)   ----------------
 Connected atoms:     3(C )   --     4(C )
 Position (Bohr):        1.664410364630    6.157816333738   -0.896375801802
 Position (Angstrom):    0.880768034553    3.258576072741   -0.474341646719
 Density of all electrons:  0.3024919073E+00
 Density of Alpha electrons:  0.1512459536E+00
 Density of Beta electrons:  0.1512459536E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.9020632450E-01
 G(r) in X,Y,Z:  0.1416556054E-01  0.3701399533E-01  0.3902676863E-01
 Hamiltonian kinetic energy K(r):  0.3099586941E+00
 Potential energy density V(r): -0.4001650186E+00
 Energy density E(r) or H(r): -0.3099586941E+00
 Laplacian of electron density: -0.8790094782E+00
 Electron localization function (ELF):  0.9495451593E+00
 Localized orbital locator (LOL):  0.8126866989E+00
 Local information entropy:  0.4712131606E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3024919073E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2110209736E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3096015984E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1085923262E-01
 Wavefunction value for orbital         1 : -0.7263932509E-07
 Average local ionization energy (ALIE):  0.6551961954E+00
 Delta-g (under promolecular approximation):  0.3756453585E+00
 Delta-g (under Hirshfeld partition):  0.5507602820E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5846707181E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1301042607E-16  0.9486769009E-16 -0.3838075691E-16
 Norm of gradient is:  0.1031611958E-15
 
 Components of Laplacian in x/y/z are:
  0.1231115904E+00 -0.6196153040E+00 -0.3825057646E+00
 Total: -0.8790094782E+00
 
 Hessian matrix:
  0.1231115904E+00  0.7562136409E-01  0.3731523476E+00
  0.7562136409E-01 -0.6196153040E+00  0.1530376079E-01
  0.3731523476E+00  0.1530376079E-01 -0.3825057646E+00
 Eigenvalues of Hessian: -0.6342634553E+00 -0.5715615858E+00  0.3268155629E+00
 Eigenvectors(columns) of Hessian:
  0.2393949286E+00 -0.4067391721E+00 -0.8816197106E+00
 -0.9238431771E+00 -0.3747459537E+00 -0.7796957311E-01
 -0.2986701396E+00  0.8331438748E+00 -0.4654754898E+00
 Determinant of Hessian:  0.1184773826E+00
 Ellipticity of electron density:    0.109703
 eta index:    1.940738
 
 ----------------   CP   241,     Type (3,+1)   ----------------
 Position (Bohr):        1.937811927977    7.285781922997    3.167865292106
 Position (Angstrom):    1.025445911302    3.855469757259    1.676362119793
 Density of all electrons:  0.3339397569E-02
 Density of Alpha electrons:  0.1669698784E-02
 Density of Beta electrons:  0.1669698784E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2359747456E-02
 G(r) in X,Y,Z:  0.3229104995E-03  0.8771516566E-03  0.1159685299E-02
 Hamiltonian kinetic energy K(r): -0.7041311129E-03
 Potential energy density V(r): -0.1655616343E-02
 Energy density E(r) or H(r):  0.7041311129E-03
 Laplacian of electron density:  0.1225551427E-01
 Electron localization function (ELF):  0.8105113826E-02
 Localized orbital locator (LOL):  0.8322363506E-01
 Local information entropy:  0.8390196660E-04
 Reduced density gradient (RDG):  0.1479989426E-14
 Reduced density gradient with promolecular approximation:  0.1431050150E+00
 Sign(lambda2)*rho:  0.3339397569E-02
 Sign(lambda2)*rho with promolecular approximation:  0.8007217338E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3689543073E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1192603105E-03
 Wavefunction value for orbital         1 :  0.3788682851E-06
 Average local ionization energy (ALIE):  0.5129366643E+00
 Delta-g (under promolecular approximation):  0.1089379269E-01
 Delta-g (under Hirshfeld partition):  0.6404643451E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4898210865E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1558540623E-17  0.3577867169E-17  0.2168404345E-17
 Norm of gradient is:  0.4464544742E-17
 
 Components of Laplacian in x/y/z are:
 -0.6371630511E-04  0.4762138523E-02  0.7557092056E-02
 Total:  0.1225551427E-01
 
 Hessian matrix:
 -0.6371630511E-04 -0.9584970856E-03 -0.3777154835E-02
 -0.9584970856E-03  0.4762138523E-02  0.1666924213E-02
 -0.3777154835E-02  0.1666924213E-02  0.7557092056E-02
 Eigenvalues of Hessian: -0.1629053720E-02  0.4054747287E-02  0.9829820707E-02
 Eigenvectors(columns) of Hessian:
 -0.9266995162E+00  0.9577743528E-01 -0.3633932988E+00
 -0.4156450196E-01  0.9349233427E+00  0.3524070593E+00
 -0.3734975220E+00 -0.3416797128E+00  0.8624120679E+00
 Determinant of Hessian: -0.6492990902E-07
 Ellipticity of electron density:   -1.401765
 eta index:    0.165726
 
 ----------------   CP   242,     Type (3,-1)   ----------------
 Connected atoms:    84(H )   --    72(C )
 Position (Bohr):        0.452920947389    8.873769888234    7.361311363854
 Position (Angstrom):    0.239675443699    4.695796799650    3.895438216113
 Density of all electrons:  0.2757740124E+00
 Density of Alpha electrons:  0.1378870062E+00
 Density of Beta electrons:  0.1378870062E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4202885017E-01
 G(r) in X,Y,Z:  0.1689045325E-01  0.1873152837E-01  0.6406868553E-02
 Hamiltonian kinetic energy K(r):  0.2755176933E+00
 Potential energy density V(r): -0.3175465435E+00
 Energy density E(r) or H(r): -0.2755176933E+00
 Laplacian of electron density: -0.9339553726E+00
 Electron localization function (ELF):  0.9845396297E+00
 Localized orbital locator (LOL):  0.8886658232E+00
 Local information entropy:  0.4349956750E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2757740124E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1795456458E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.5189484893E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6441181197E-02
 Wavefunction value for orbital         1 :  0.3323241930E-07
 Average local ionization energy (ALIE):  0.5380478250E+00
 Delta-g (under promolecular approximation):  0.2917031044E+00
 Delta-g (under Hirshfeld partition):  0.5063887160E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4275415613E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.8127552179E-15  0.1027572726E-15  0.1624975111E-14
 Norm of gradient is:  0.1819800597E-14
 
 Components of Laplacian in x/y/z are:
 -0.5071148223E+00 -0.7159101832E+00  0.2890696329E+00
 Total: -0.9339553726E+00
 
 Hessian matrix:
 -0.5071148223E+00 -0.2083679179E-01  0.4557537395E+00
 -0.2083679179E-01 -0.7159101832E+00 -0.4032581358E-01
  0.4557537395E+00 -0.4032581358E-01  0.2890696329E+00
 Eigenvalues of Hessian: -0.7187465522E+00 -0.7130148866E+00  0.4978060662E+00
 Eigenvectors(columns) of Hessian:
 -0.4204014718E+00 -0.8076979710E+00  0.4133843130E+00
 -0.8941155447E+00  0.4462782252E+00 -0.3732476896E-01
  0.1543372774E+00  0.3853047280E+00  0.9097913340E+00
 Determinant of Hessian:  0.2551141551E+00
 Ellipticity of electron density:    0.008039
 eta index:    1.443828
 
 ----------------   CP   243,     Type (3,-1)   ----------------
 Connected atoms:     8(C )   --     9(C )
 Position (Bohr):       -4.002930914410    6.670478489342   -3.034206977033
 Position (Angstrom):   -2.118259816725    3.529865202379   -1.605633185409
 Density of all electrons:  0.3083104703E+00
 Density of Alpha electrons:  0.1541552352E+00
 Density of Beta electrons:  0.1541552352E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.9866422028E-01
 G(r) in X,Y,Z:  0.3737832144E-01  0.1903628921E-01  0.4224960962E-01
 Hamiltonian kinetic energy K(r):  0.3224140772E+00
 Potential energy density V(r): -0.4210782975E+00
 Energy density E(r) or H(r): -0.3224140772E+00
 Laplacian of electron density: -0.8949994277E+00
 Electron localization function (ELF):  0.9437038888E+00
 Localized orbital locator (LOL):  0.8037178072E+00
 Local information entropy:  0.4790326229E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3083104703E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2150817169E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1743366118E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.8529393706E-02
 Wavefunction value for orbital         1 :  0.3870311563E-06
 Average local ionization energy (ALIE):  0.6685759411E+00
 Delta-g (under promolecular approximation):  0.3782246688E+00
 Delta-g (under Hirshfeld partition):  0.5572830735E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5604107636E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.1537669731E-15  0.1798928573E-16  0.7537237978E-16
 Norm of gradient is:  0.1721885364E-15
 
 Components of Laplacian in x/y/z are:
 -0.5805720800E+00  0.2808412334E-01 -0.3425114711E+00
 Total: -0.8949994277E+00
 
 Hessian matrix:
 -0.5805720800E+00  0.2043488936E+00  0.9879911666E-01
  0.2043488936E+00  0.2808412334E-01  0.3815198322E+00
  0.9879911666E-01  0.3815198322E+00 -0.3425114711E+00
 Eigenvalues of Hessian: -0.6458067789E+00 -0.5724836531E+00  0.3232910043E+00
 Eigenvectors(columns) of Hessian:
 -0.9099074661E+00 -0.3366423406E+00  0.2423640600E+00
  0.3755940325E+00 -0.4206384363E+00  0.8258283288E+00
 -0.1760611423E+00  0.8424578568E+00  0.5091829079E+00
 Determinant of Hessian:  0.1195251534E+00
 Ellipticity of electron density:    0.128079
 eta index:    1.997602
 
 ----------------   CP   244,     Type (3,+1)   ----------------
 Position (Bohr):        4.851735341893    7.158386911851    1.356411976533
 Position (Angstrom):    2.567427776262    3.788055220578    0.717782306577
 Density of all electrons:  0.1789362895E-01
 Density of Alpha electrons:  0.8946814474E-02
 Density of Beta electrons:  0.8946814474E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1809640639E-01
 G(r) in X,Y,Z:  0.1033538952E-01  0.2848173632E-02  0.4912843239E-02
 Hamiltonian kinetic energy K(r): -0.2734103211E-02
 Potential energy density V(r): -0.1536230318E-01
 Energy density E(r) or H(r):  0.2734103211E-02
 Laplacian of electron density:  0.8332203841E-01
 Electron localization function (ELF):  0.3631364011E-01
 Localized orbital locator (LOL):  0.1626374303E+00
 Local information entropy:  0.3859371263E-03
 Reduced density gradient (RDG):  0.1448592575E-14
 Reduced density gradient with promolecular approximation:  0.3094622298E+00
 Sign(lambda2)*rho:  0.1789362895E-01
 Sign(lambda2)*rho with promolecular approximation:  0.2570947476E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4144265006E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.7574851998E-03
 Wavefunction value for orbital         1 : -0.3681221040E-06
 Average local ionization energy (ALIE):  0.5986627532E+00
 Delta-g (under promolecular approximation):  0.4119385315E-01
 Delta-g (under Hirshfeld partition):  0.3651880272E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5109193135E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2783689078E-16  0.2116227115E-16  0.2572269654E-16
 Norm of gradient is:  0.4340957643E-16
 
 Components of Laplacian in x/y/z are:
  0.6651281215E-01 -0.2794549405E-03  0.1708868120E-01
 Total:  0.8332203841E-01
 
 Hessian matrix:
  0.6651281215E-01 -0.3581931697E-02  0.4953502867E-01
 -0.3581931697E-02 -0.2794549405E-03  0.4315406514E-02
  0.4953502867E-01  0.4315406514E-02  0.1708868120E-01
 Eigenvalues of Hessian: -0.1557414579E-01  0.1732173763E-02  0.9716401044E-01
 Eigenvectors(columns) of Hessian:
  0.4964893448E+00  0.1731475812E+00  0.8505987571E+00
  0.3414500201E+00 -0.9398660262E+00 -0.7983514700E-02
 -0.7980665475E+00 -0.2944006927E+00  0.5257547126E+00
 Determinant of Hessian: -0.2621205823E-05
 Ellipticity of electron density:   -9.991099
 eta index:    0.160287
 
 ----------------   CP   245,     Type (3,-1)   ----------------
 Connected atoms:     3(C )   --    10(C )
 Position (Bohr):       -0.427477685612    7.060085076064   -1.420146032650
 Position (Angstrom):   -0.226211449395    3.736036129289   -0.751508916633
 Density of all electrons:  0.3069547395E+00
 Density of Alpha electrons:  0.1534773698E+00
 Density of Beta electrons:  0.1534773698E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.9414192233E-01
 G(r) in X,Y,Z:  0.2452368034E-01  0.2191502312E-01  0.4770321887E-01
 Hamiltonian kinetic energy K(r):  0.3181624649E+00
 Potential energy density V(r): -0.4123043872E+00
 Energy density E(r) or H(r): -0.3181624649E+00
 Laplacian of electron density: -0.8960821703E+00
 Electron localization function (ELF):  0.9477635793E+00
 Localized orbital locator (LOL):  0.8098858722E+00
 Local information entropy:  0.4772127757E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3069547395E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2136831585E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1741887494E-04
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9884419397E-02
 Wavefunction value for orbital         1 :  0.1012172225E-06
 Average local ionization energy (ALIE):  0.6587643974E+00
 Delta-g (under promolecular approximation):  0.3819170103E+00
 Delta-g (under Hirshfeld partition):  0.5574455576E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5724966252E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2333203075E-15  0.3924811864E-16  0.4434386885E-16
 Norm of gradient is:  0.2407180081E-15
 
 Components of Laplacian in x/y/z are:
 -0.2100671828E+00 -0.9550124260E-01 -0.5905137449E+00
 Total: -0.8960821703E+00
 
 Hessian matrix:
 -0.2100671828E+00 -0.4707428677E+00 -0.7431536207E-01
 -0.4707428677E+00 -0.9550124260E-01  0.3510751750E-01
 -0.7431536207E-01  0.3510751750E-01 -0.5905137449E+00
 Eigenvalues of Hessian: -0.6474914506E+00 -0.5762464948E+00  0.3276557750E+00
 Eigenvectors(columns) of Hessian:
 -0.6595154881E+00 -0.3544666596E+00  0.6628670366E+00
 -0.5284404773E+00 -0.4085157005E+00 -0.7442214619E+00
 -0.5345932874E+00  0.8411113539E+00 -0.8210790077E-01
 Determinant of Hessian:  0.1222531793E+00
 Ellipticity of electron density:    0.123636
 eta index:    1.976133
 
 ----------------   CP   246,     Type (3,-1)   ----------------
 Connected atoms:    33(O )   --    41(H )
 Position (Bohr):        4.837056275954    7.239884275461    1.382029272196
 Position (Angstrom):    2.559659949090    3.831181768149    0.731338395647
 Density of all electrons:  0.1789575684E-01
 Density of Alpha electrons:  0.8947878420E-02
 Density of Beta electrons:  0.8947878420E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1762891248E-01
 G(r) in X,Y,Z:  0.1035427557E-01  0.2443747895E-02  0.4830889015E-02
 Hamiltonian kinetic energy K(r): -0.2673981890E-02
 Potential energy density V(r): -0.1495493059E-01
 Energy density E(r) or H(r):  0.2673981890E-02
 Laplacian of electron density:  0.8121157749E-01
 Electron localization function (ELF):  0.3820410681E-01
 Localized orbital locator (LOL):  0.1662608655E+00
 Local information entropy:  0.3859785130E-03
 Reduced density gradient (RDG):  0.1345919604E-14
 Reduced density gradient with promolecular approximation:  0.3148830761E+00
 Sign(lambda2)*rho: -0.1789575684E-01
 Sign(lambda2)*rho with promolecular approximation:  0.2513579841E-01
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4378795127E-06
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.7330493038E-03
 Wavefunction value for orbital         1 : -0.3874800533E-06
 Average local ionization energy (ALIE):  0.5890159077E+00
 Delta-g (under promolecular approximation):  0.4055964695E-01
 Delta-g (under Hirshfeld partition):  0.3659409955E-01
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5080623781E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3363059614E-16 -0.1726930773E-16  0.1473837328E-16
 Norm of gradient is:  0.4057666365E-16
 
 Components of Laplacian in x/y/z are:
  0.6766070518E-01 -0.3289758538E-02  0.1684063085E-01
 Total:  0.8121157749E-01
 
 Hessian matrix:
  0.6766070518E-01 -0.3712456026E-02  0.5054598944E-01
 -0.3712456026E-02 -0.3289758538E-02  0.3076086759E-02
  0.5054598944E-01  0.3076086759E-02  0.1684063085E-01
 Eigenvalues of Hessian: -0.1597026257E-01 -0.1665818100E-02  0.9884765816E-01
 Eigenvectors(columns) of Hessian:
  0.4975553545E+00  0.1657818907E+00  0.8514429129E+00
  0.3393255718E+00 -0.9405468301E+00 -0.1515970506E-01
 -0.7983087282E+00 -0.2964591457E+00  0.5242281463E+00
 Determinant of Hessian:  0.2629698859E-05
 Ellipticity of electron density:    8.587039
 eta index:    0.161564
 
 ----------------   CP   247,     Type (3,-1)   ----------------
 Connected atoms:     4(C )   --    41(H )
 Position (Bohr):        3.100009194227    7.413233750170    0.360604480338
 Position (Angstrom):    1.640454219175    3.922914359687    0.190823673144
 Density of all electrons:  0.2905173911E+00
 Density of Alpha electrons:  0.1452586956E+00
 Density of Beta electrons:  0.1452586956E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3431898519E-01
 G(r) in X,Y,Z:  0.1471192778E-01  0.6249887439E-02  0.1335716997E-01
 Hamiltonian kinetic energy K(r):  0.2989769262E+00
 Potential energy density V(r): -0.3332959114E+00
 Energy density E(r) or H(r): -0.2989769262E+00
 Laplacian of electron density: -0.1058631764E+01
 Electron localization function (ELF):  0.9912742096E+00
 Localized orbital locator (LOL):  0.9142482315E+00
 Local information entropy:  0.4550456882E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2905173911E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1813835208E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1035637780E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.1047359834E-01
 Wavefunction value for orbital         1 : -0.1813553692E-06
 Average local ionization energy (ALIE):  0.5734577269E+00
 Delta-g (under promolecular approximation):  0.3216144305E+00
 Delta-g (under Hirshfeld partition):  0.5506822530E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5346837043E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2082210272E-15  0.1000176504E-15 -0.1361757929E-15
 Norm of gradient is:  0.2681480433E-15
 
 Components of Laplacian in x/y/z are:
 -0.7519656835E+00  0.1891448139E+00 -0.4958108944E+00
 Total: -0.1058631764E+01
 
 Hessian matrix:
 -0.7519656835E+00  0.2466139402E+00  0.1334222274E+00
  0.2466139402E+00  0.1891448139E+00  0.5558922223E+00
  0.1334222274E+00  0.5558922223E+00 -0.4958108944E+00
 Eigenvalues of Hessian: -0.8137114149E+00 -0.8044460671E+00  0.5595257180E+00
 Eigenvectors(columns) of Hessian:
 -0.8772834332E+00 -0.4320527977E+00  0.2090553943E+00
  0.3789886269E+00 -0.3562833242E+00  0.8540666330E+00
 -0.2945189274E+00  0.8284881248E+00  0.4763045544E+00
 Determinant of Hessian:  0.3662582318E+00
 Ellipticity of electron density:    0.011518
 eta index:    1.454288
 
 ----------------   CP   248,     Type (3,-1)   ----------------
 Connected atoms:    41(H )   --    83(H )
 Position (Bohr):        2.131684625928    8.349269750614    2.808845823106
 Position (Angstrom):    1.128038924873    4.418243279707    1.486377198528
 Density of all electrons:  0.4045154552E-02
 Density of Alpha electrons:  0.2022577276E-02
 Density of Beta electrons:  0.2022577276E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.2621631576E-02
 G(r) in X,Y,Z:  0.4022826749E-03  0.3734765480E-03  0.1845872353E-02
 Hamiltonian kinetic energy K(r): -0.6320315664E-03
 Potential energy density V(r): -0.1989600010E-02
 Energy density E(r) or H(r):  0.6320315664E-03
 Laplacian of electron density:  0.1301465257E-01
 Electron localization function (ELF):  0.1239896965E-01
 Localized orbital locator (LOL):  0.1011032824E+00
 Local information entropy:  0.9999085989E-04
 Reduced density gradient (RDG):  0.6189127658E-15
 Reduced density gradient with promolecular approximation:  0.2852413116E-01
 Sign(lambda2)*rho: -0.4045154552E-02
 Sign(lambda2)*rho with promolecular approximation: -0.8850916209E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2739257799E-05
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.1142706750E-03
 Wavefunction value for orbital         1 :  0.2701644550E-06
 Average local ionization energy (ALIE):  0.5062174461E+00
 Delta-g (under promolecular approximation):  0.1330924789E-01
 Delta-g (under Hirshfeld partition):  0.7764821883E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4669959914E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.1558540623E-18 -0.1273937553E-17  0.1694065895E-17
 Norm of gradient is:  0.2125339180E-17
 
 Components of Laplacian in x/y/z are:
  0.4262155739E-04 -0.1685271541E-03  0.1314055817E-01
 Total:  0.1301465257E-01
 
 Hessian matrix:
  0.4262155739E-04 -0.2477697420E-02 -0.6885593361E-02
 -0.2477697420E-02 -0.1685271541E-03  0.6178744294E-02
 -0.6885593361E-02  0.6178744294E-02  0.1314055817E-01
 Eigenvalues of Hessian: -0.2964470235E-02 -0.2491486812E-02  0.1847060962E-01
 Eigenvectors(columns) of Hessian:
 -0.8220888930E+00  0.4336249149E+00 -0.3689705751E+00
  0.3168601604E+00  0.8868579855E+00  0.3362774929E+00
 -0.4730428002E+00 -0.1595379162E+00  0.8664745596E+00
 Determinant of Hessian:  0.1364227866E-06
 Ellipticity of electron density:    0.189840
 eta index:    0.160497
 
 ----------------   CP   249,     Type (3,-1)   ----------------
 Connected atoms:    72(C )   --    83(H )
 Position (Bohr):        0.869751388747    9.197664765570    5.300945840824
 Position (Angstrom):    0.460252614076    4.867194587465    2.805139735195
 Density of all electrons:  0.2762380541E+00
 Density of Alpha electrons:  0.1381190271E+00
 Density of Beta electrons:  0.1381190271E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4196475996E-01
 G(r) in X,Y,Z:  0.1114928059E-01  0.1825057909E-01  0.1256490027E-01
 Hamiltonian kinetic energy K(r):  0.2764311800E+00
 Potential energy density V(r): -0.3183959399E+00
 Energy density E(r) or H(r): -0.2764311800E+00
 Laplacian of electron density: -0.9378656801E+00
 Electron localization function (ELF):  0.9846708296E+00
 Localized orbital locator (LOL):  0.8890933304E+00
 Local information entropy:  0.4356292406E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2762380541E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1797534384E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.4390688561E-07
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.7006833061E-02
 Wavefunction value for orbital         1 :  0.2536235048E-07
 Average local ionization energy (ALIE):  0.5375181402E+00
 Delta-g (under promolecular approximation):  0.2926413691E+00
 Delta-g (under Hirshfeld partition):  0.5076509095E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4557304182E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.5234413739E-15 -0.5929569444E-16 -0.5940657105E-15
 Norm of gradient is:  0.7939905036E-15
 
 Components of Laplacian in x/y/z are:
 -0.6964633576E-01 -0.6669373332E+00 -0.2012820112E+00
 Total: -0.9378656801E+00
 
 Hessian matrix:
 -0.6964633576E-01  0.1839011198E+00 -0.5790636359E+00
  0.1839011198E+00 -0.6669373332E+00 -0.1678136152E+00
 -0.5790636359E+00 -0.1678136152E+00 -0.2012820112E+00
 Eigenvalues of Hessian: -0.7219344261E+00 -0.7163485037E+00  0.5004172497E+00
 Eigenvectors(columns) of Hessian:
 -0.2631883016E+00 -0.6316020735E+00 -0.7292535489E+00
 -0.7936385887E+00  0.5715221854E+00 -0.2085669729E+00
 -0.5485159145E+00 -0.5238713700E+00  0.6516817315E+00
 Determinant of Hessian:  0.2587941064E+00
 Ellipticity of electron density:    0.007798
 eta index:    1.442665
 
 ----------------   CP   250,     Type (3,-1)   ----------------
 Connected atoms:     9(C )   --    10(C )
 Position (Bohr):       -2.455314049853    7.918756350196   -1.813424792015
 Position (Angstrom):   -1.299296240792    4.190425399217   -0.959623073621
 Density of all electrons:  0.3296257924E+00
 Density of Alpha electrons:  0.1648128962E+00
 Density of Beta electrons:  0.1648128962E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1195197560E+00
 G(r) in X,Y,Z:  0.1491988905E-01  0.4735074231E-01  0.5724912466E-01
 Hamiltonian kinetic energy K(r):  0.3658782902E+00
 Potential energy density V(r): -0.4853980462E+00
 Energy density E(r) or H(r): -0.3658782902E+00
 Laplacian of electron density: -0.9854341368E+00
 Electron localization function (ELF):  0.9345353757E+00
 Localized orbital locator (LOL):  0.7907336678E+00
 Local information entropy:  0.5074823873E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.3296257924E+00
 Sign(lambda2)*rho with promolecular approximation: -0.2281491204E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3378020247E-09
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9240166298E-02
 Wavefunction value for orbital         1 :  0.1159553865E-06
 Average local ionization energy (ALIE):  0.6785194183E+00
 Delta-g (under promolecular approximation):  0.3920695936E+00
 Delta-g (under Hirshfeld partition):  0.5853492270E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5605736455E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.8294146620E-16  0.6900946828E-16  0.3252606517E-17
 Norm of gradient is:  0.1079452314E-15
 
 Components of Laplacian in x/y/z are:
  0.1587541650E+00 -0.6794775962E+00 -0.4647107056E+00
 Total: -0.9854341368E+00
 
 Hessian matrix:
  0.1587541650E+00  0.1050747641E+00  0.3410105880E+00
  0.1050747641E+00 -0.6794775962E+00 -0.3393650407E-02
  0.3410105880E+00 -0.3393650407E-02 -0.4647107056E+00
 Eigenvalues of Hessian: -0.7100547745E+00 -0.5934500005E+00  0.3180706381E+00
 Eigenvectors(columns) of Hessian:
  0.2499606548E+00 -0.3229674301E+00 -0.9128043110E+00
 -0.8988991494E+00 -0.4277777989E+00 -0.9479701460E-01
 -0.3598610708E+00  0.8442145425E+00 -0.3972427670E+00
 Determinant of Hessian:  0.1340292436E+00
 Ellipticity of electron density:    0.196486
 eta index:    2.232381
 
 ----------------   CP   251,     Type (3,-1)   ----------------
 Connected atoms:    72(C )   --    85(H )
 Position (Bohr):       -0.935885042677    9.936803556899    6.150526409872
 Position (Angstrom):   -0.495249036610    5.258329991531    3.254718411161
 Density of all electrons:  0.2768361227E+00
 Density of Alpha electrons:  0.1384180614E+00
 Density of Beta electrons:  0.1384180614E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4184397057E-01
 G(r) in X,Y,Z:  0.1242855609E-01  0.9666450952E-02  0.1974896353E-01
 Hamiltonian kinetic energy K(r):  0.2772503541E+00
 Potential energy density V(r): -0.3190943246E+00
 Energy density E(r) or H(r): -0.2772503541E+00
 Laplacian of electron density: -0.9416255339E+00
 Electron localization function (ELF):  0.9848654151E+00
 Localized orbital locator (LOL):  0.8897313789E+00
 Local information entropy:  0.4364455523E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2768361227E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1799635190E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2024608509E-08
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.6391517979E-02
 Wavefunction value for orbital         1 : -0.3968141994E-07
 Average local ionization energy (ALIE):  0.5384351186E+00
 Delta-g (under promolecular approximation):  0.2929782505E+00
 Delta-g (under Hirshfeld partition):  0.5086010887E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.4279699183E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.2192045035E-15  0.3800463193E-15  0.1819934990E-15
 Norm of gradient is:  0.4749815289E-15
 
 Components of Laplacian in x/y/z are:
 -0.2218456292E+00 -0.1223924949E-02 -0.7185559797E+00
 Total: -0.9416255339E+00
 
 Hessian matrix:
 -0.2218456292E+00 -0.6020919325E+00  0.5650379799E-02
 -0.6020919325E+00 -0.1223924949E-02 -0.8795766512E-02
  0.5650379799E-02 -0.8795766512E-02 -0.7185559797E+00
 Eigenvalues of Hessian: -0.7239617758E+00 -0.7183309536E+00  0.5006671954E+00
 Eigenvectors(columns) of Hessian:
  0.7452276892E+00 -0.1864958304E+00 -0.6401991850E+00
  0.6236981598E+00 -0.1446651270E+00  0.7681618361E+00
  0.2358734759E+00  0.9717465237E+00 -0.8508647889E-02
 Determinant of Hessian:  0.2603690475E+00
 Ellipticity of electron density:    0.007839
 eta index:    1.445994
 
 ----------------   CP   252,     Type (3,-1)   ----------------
 Connected atoms:     9(C )   --    27(S )
 Position (Bohr):       -4.753446507942    8.903324460985   -2.148470113377
 Position (Angstrom):   -2.515415565249    4.711436406028   -1.136921422305
 Density of all electrons:  0.2031184279E+00
 Density of Alpha electrons:  0.1015592140E+00
 Density of Beta electrons:  0.1015592140E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4130294561E-01
 G(r) in X,Y,Z:  0.1271475314E-01  0.1326882233E-01  0.1531937014E-01
 Hamiltonian kinetic energy K(r):  0.1485164977E+00
 Potential energy density V(r): -0.1898194433E+00
 Energy density E(r) or H(r): -0.1485164977E+00
 Laplacian of electron density: -0.4288542082E+00
 Electron localization function (ELF):  0.9596672294E+00
 Localized orbital locator (LOL):  0.8299048722E+00
 Local information entropy:  0.3335508002E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2031184279E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1303769796E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.3553433327E-06
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.3307234947E-02
 Wavefunction value for orbital         1 : -0.1392096220E-06
 Average local ionization energy (ALIE):  0.6220072201E+00
 Delta-g (under promolecular approximation):  0.2606152260E+00
 Delta-g (under Hirshfeld partition):  0.3769954581E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5411704027E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2035860629E-15  0.4702726923E-16  0.4597017211E-16
 Norm of gradient is:  0.2139441651E-15
 
 Components of Laplacian in x/y/z are:
 -0.5594747518E-01 -0.4032530260E-01 -0.3325814304E+00
 Total: -0.4288542082E+00
 
 Hessian matrix:
 -0.5594747518E-01 -0.3002922871E+00 -0.5834831876E-01
 -0.3002922871E+00 -0.4032530260E-01  0.5157444877E-01
 -0.5834831876E-01  0.5157444877E-01 -0.3325814304E+00
 Eigenvalues of Hessian: -0.3520685405E+00 -0.3391802976E+00  0.2623946300E+00
 Eigenvectors(columns) of Hessian:
  0.6566800384E+00 -0.2978485351E+00  0.6928618746E+00
  0.5465931595E+00 -0.4450252746E+00 -0.7093577538E+00
  0.5196222139E+00  0.8445346382E+00 -0.1294372426E+00
 Determinant of Hessian:  0.3133377927E-01
 Ellipticity of electron density:    0.037998
 eta index:    1.341752
 
 ----------------   CP   253,     Type (3,-1)   ----------------
 Connected atoms:    10(C )   --    43(H )
 Position (Bohr):       -0.965820406983    9.146796024788   -0.630970849479
 Position (Angstrom):   -0.511090149201    4.840276009096   -0.333895394289
 Density of all electrons:  0.2891410829E+00
 Density of Alpha electrons:  0.1445705414E+00
 Density of Beta electrons:  0.1445705414E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.3346745984E-01
 G(r) in X,Y,Z:  0.1407520534E-01  0.7007822904E-02  0.1238443159E-01
 Hamiltonian kinetic energy K(r):  0.2966650596E+00
 Potential energy density V(r): -0.3301325194E+00
 Energy density E(r) or H(r): -0.2966650596E+00
 Laplacian of electron density: -0.1052790399E+01
 Electron localization function (ELF):  0.9915668375E+00
 Localized orbital locator (LOL):  0.9155879301E+00
 Local information entropy:  0.4531808362E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2891410829E+00
 Sign(lambda2)*rho with promolecular approximation: -0.1807681885E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.2374912920E-05
 Source function, ref.:   0.00000   0.00000   0.00000 :  0.9087320510E-02
 Wavefunction value for orbital         1 :  0.1928886051E-06
 Average local ionization energy (ALIE):  0.5788466034E+00
 Delta-g (under promolecular approximation):  0.3196807327E+00
 Delta-g (under Hirshfeld partition):  0.5476956349E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5123808096E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.4264980296E-16 -0.3149607311E-16  0.1472346550E-15
 Norm of gradient is:  0.1564897823E-15
 
 Components of Laplacian in x/y/z are:
 -0.7241805534E+00  0.1250798372E+00 -0.4536896827E+00
 Total: -0.1052790399E+01
 
 Hessian matrix:
 -0.7241805534E+00  0.2780627467E+00  0.1676296326E+00
  0.2780627467E+00  0.1250798372E+00  0.5674062457E+00
  0.1676296326E+00  0.5674062457E+00 -0.4536896827E+00
 Eigenvalues of Hessian: -0.8073913006E+00 -0.8004393819E+00  0.5550402836E+00
 Eigenvectors(columns) of Hessian:
 -0.9113530830E+00 -0.3300244487E+00  0.2460069538E+00
  0.3750211991E+00 -0.4193321860E+00  0.8267524527E+00
 -0.1696898887E+00  0.8457212194E+00  0.5059258450E+00
 Determinant of Hessian:  0.3587046595E+00
 Ellipticity of electron density:    0.008685
 eta index:    1.454654
 
 ----------------   CP   254,     Type (3,-1)   ----------------
 Connected atoms:    32(O )   --    27(S )
 Position (Bohr):       -6.839002026373    9.704181673751   -1.312942909159
 Position (Angstrom):   -3.619044017676    5.135231792212   -0.694779466743
 Density of all electrons:  0.2761225504E+00
 Density of Alpha electrons:  0.1380612752E+00
 Density of Beta electrons:  0.1380612752E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4462688010E+00
 G(r) in X,Y,Z:  0.1915498364E+00  0.1168745366E+00  0.1378444280E+00
 Hamiltonian kinetic energy K(r):  0.3362445959E+00
 Potential energy density V(r): -0.7825133970E+00
 Energy density E(r) or H(r): -0.3362445959E+00
 Laplacian of electron density:  0.4400968205E+00
 Electron localization function (ELF):  0.3620228797E+00
 Localized orbital locator (LOL):  0.4296510262E+00
 Local information entropy:  0.4354715565E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2761225504E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3321082755E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.9176341235E-09
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2932086240E-02
 Wavefunction value for orbital         1 :  0.1019218580E-06
 Average local ionization energy (ALIE):  0.1504555139E+01
 Delta-g (under promolecular approximation):  0.2650641381E+00
 Delta-g (under Hirshfeld partition):  0.3428417851E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5608191665E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.2096847002E-15 -0.2176705268E-15 -0.2635966532E-16
 Norm of gradient is:  0.3033858330E-15
 
 Components of Laplacian in x/y/z are:
  0.4942274044E+00 -0.1073262706E+00  0.5319568674E-01
 Total:  0.4400968205E+00
 
 Hessian matrix:
  0.4942274044E+00  0.5787448372E+00 -0.7159162220E+00
  0.5787448372E+00 -0.1073262706E+00 -0.4338582052E+00
 -0.7159162220E+00 -0.4338582052E+00  0.5319568674E-01
 Eigenvalues of Hessian: -0.4767459276E+00 -0.4587622434E+00  0.1375604991E+01
 Eigenvectors(columns) of Hessian:
  0.4756904423E+00  0.5019767346E+00  0.7223143090E+00
  0.2464403376E+00 -0.8643422035E+00  0.4383830692E+00
  0.8443848430E+00 -0.3052725392E-01 -0.5348666410E+00
 Determinant of Hessian:  0.3008627375E+00
 Ellipticity of electron density:    0.039200
 eta index:    0.346572
 
 ----------------   CP   255,     Type (3,-1)   ----------------
 Connected atoms:    27(S )   --    30(O )
 Position (Bohr):       -6.373136549086   10.478683685474   -2.935385168462
 Position (Angstrom):   -3.372518623749    5.545080606614   -1.553338936373
 Density of all electrons:  0.2768119367E+00
 Density of Alpha electrons:  0.1384059683E+00
 Density of Beta electrons:  0.1384059683E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4498676442E+00
 G(r) in X,Y,Z:  0.9509710286E-01  0.8881835357E-01  0.2659521877E+00
 Hamiltonian kinetic energy K(r):  0.3369145309E+00
 Potential energy density V(r): -0.7867821750E+00
 Energy density E(r) or H(r): -0.3369145309E+00
 Laplacian of electron density:  0.4518124531E+00
 Electron localization function (ELF):  0.3602344528E+00
 Localized orbital locator (LOL):  0.4287014624E+00
 Local information entropy:  0.4364125457E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2768119367E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3331322222E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1053850232E-07
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.2851020778E-02
 Wavefunction value for orbital         1 :  0.2778482256E-06
 Average local ionization energy (ALIE):  0.1510159067E+01
 Delta-g (under promolecular approximation):  0.2665307059E+00
 Delta-g (under Hirshfeld partition):  0.3449180256E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5482254641E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
 -0.4971744587E-16 -0.3714984863E-15  0.1790627650E-15
 Norm of gradient is:  0.4153870768E-15
 
 Components of Laplacian in x/y/z are:
 -0.2967997948E+00 -0.3483482714E+00  0.1096960519E+01
 Total:  0.4518124531E+00
 
 Hessian matrix:
 -0.2967997948E+00 -0.1531553308E+00  0.5202385492E+00
 -0.1531553308E+00 -0.3483482714E+00 -0.4318356359E+00
  0.5202385492E+00 -0.4318356359E+00  0.1096960519E+01
 Eigenvalues of Hessian: -0.4782519983E+00 -0.4603589189E+00  0.1390423370E+01
 Eigenvectors(columns) of Hessian:
  0.7366421551E+00 -0.6031079430E+00  0.3059724571E+00
  0.6737403650E+00  0.6936603842E+00 -0.2547728242E+00
 -0.5858545819E-01  0.3938223972E+00  0.9173176460E+00
 Determinant of Hessian:  0.3061261388E+00
 Ellipticity of electron density:    0.038868
 eta index:    0.343961
 
 ----------------   CP   256,     Type (3,-1)   ----------------
 Connected atoms:    27(S )   --    31(O )
 Position (Bohr):       -5.537241485177   11.033082070717   -1.366189787168
 Position (Angstrom):   -2.930182005222    5.838455597846   -0.722956501138
 Density of all electrons:  0.2779200630E+00
 Density of Alpha electrons:  0.1389600315E+00
 Density of Beta electrons:  0.1389600315E+00
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.4558758687E+00
 G(r) in X,Y,Z:  0.1203465001E+00  0.2060876049E+00  0.1294417638E+00
 Hamiltonian kinetic energy K(r):  0.3380950442E+00
 Potential energy density V(r): -0.7939709130E+00
 Energy density E(r) or H(r): -0.3380950442E+00
 Laplacian of electron density:  0.4711232982E+00
 Electron localization function (ELF):  0.3571941834E+00
 Localized orbital locator (LOL):  0.4270836992E+00
 Local information entropy:  0.4379243391E-02
 Reduced density gradient (RDG):  0.1000000000E+03
 Reduced density gradient with promolecular approximation:  0.1000000000E+03
 Sign(lambda2)*rho: -0.2779200630E+00
 Sign(lambda2)*rho with promolecular approximation: -0.3348178187E+00
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.1449722886E-08
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.3018582826E-02
 Wavefunction value for orbital         1 : -0.1286797184E-06
 Average local ionization energy (ALIE):  0.1519738994E+01
 Delta-g (under promolecular approximation):  0.2689175694E+00
 Delta-g (under Hirshfeld partition):  0.3478467734E+00
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5527176962E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3513759481E-15  0.3435845155E-15  0.3156061702E-15
 Norm of gradient is:  0.5840570442E-15
 
 Components of Laplacian in x/y/z are:
 -0.9580576437E-01  0.5968694324E+00 -0.2994036991E-01
 Total:  0.4711232982E+00
 
 Hessian matrix:
 -0.9580576437E-01  0.6217074944E+00  0.4094316527E+00
  0.6217074944E+00  0.5968694324E+00  0.6964015640E+00
  0.4094316527E+00  0.6964015640E+00 -0.2994036991E-01
 Eigenvalues of Hessian: -0.4818669266E+00 -0.4611339776E+00  0.1414124202E+01
 Eigenvectors(columns) of Hessian:
 -0.2539188148E+00  0.8602310799E+00  0.4421851702E+00
 -0.4170465458E+00 -0.5098611824E+00  0.7524053119E+00
  0.8726954876E+00  0.6638067178E-02  0.4882197476E+00
 Determinant of Hessian:  0.3142257689E+00
 Ellipticity of electron density:    0.044961
 eta index:    0.340753
 
 ----------------   CP   257,     Type (3,+1)   ----------------
 Position (Bohr):       -0.175111123261   -1.585937658333   -0.965689198346
 Position (Angstrom):   -0.092664815805   -0.839242066703   -0.511020716580
 Density of all electrons:  0.2989715048E-02
 Density of Alpha electrons:  0.1494857524E-02
 Density of Beta electrons:  0.1494857524E-02
 Spin density of electrons:  0.0000000000E+00
 Lagrangian kinetic energy G(r):  0.1954520405E-02
 G(r) in X,Y,Z:  0.2836598780E-03  0.5223113657E-03  0.1148549161E-02
 Hamiltonian kinetic energy K(r): -0.5361352618E-03
 Potential energy density V(r): -0.1418385143E-02
 Energy density E(r) or H(r):  0.5361352618E-03
 Laplacian of electron density:  0.9962622665E-02
 Electron localization function (ELF):  0.8156426549E-02
 Localized orbital locator (LOL):  0.8353361007E-01
 Local information entropy:  0.7581686914E-04
 Reduced density gradient (RDG):  0.1121312007E-14
 Reduced density gradient with promolecular approximation:  0.4306669557E+00
 Sign(lambda2)*rho:  0.2989715048E-02
 Sign(lambda2)*rho with promolecular approximation:  0.4428559859E-02
 Corr. hole for alpha, ref.:   0.00000   0.00000   0.00000 : -0.7313386949E-03
 Source function, ref.:   0.00000   0.00000   0.00000 : -0.4250822258E-03
 Wavefunction value for orbital         1 : -0.1018468645E-05
 Average local ionization energy (ALIE):  0.4879129271E+00
 Delta-g (under promolecular approximation):  0.5946399073E-02
 Delta-g (under Hirshfeld partition):  0.5991169288E-02
 User-defined real space function:  0.1000000000E+01
 ESP from nuclear charges:  0.5735632280E+02
 
 Note: Below information are for electron density
 
 Components of gradient in x/y/z are:
  0.3032377951E-18 -0.2266660167E-17 -0.2087089182E-17
 Norm of gradient is:  0.3096068915E-17
 
 Components of Laplacian in x/y/z are:
  0.1012427402E-04  0.1980723847E-02  0.7971774544E-02
 Total:  0.9962622665E-02
 
 Hessian matrix:
  0.1012427402E-04  0.1696122692E-02 -0.2961647196E-02
  0.1696122692E-02  0.1980723847E-02 -0.2193731234E-02
 -0.2961647196E-02 -0.2193731234E-02  0.7971774544E-02
 Eigenvalues of Hessian: -0.1295501014E-02  0.1425322575E-02  0.9832801105E-02
 Eigenvectors(columns) of Hessian:
  0.9185952446E+00  0.2267889701E+00 -0.3236503355E+00
 -0.3315449059E+00  0.8879440774E+00 -0.3187997660E+00
  0.2150831279E+00  0.4001525690E+00  0.8908519347E+00
 Determinant of Hessian: -0.1815633451E-07
 Ellipticity of electron density:   -1.908918
 eta index:    0.131753
 
