HCl                                     
           1
    24.837400    0.000000    0.000000
     0.000000   24.837400    0.000000
     0.000000    0.000000   24.837400
   O    H    Cl
 511 1023   1
Direct configuration=    42
   0.17515631  0.12481456  0.58405309
   0.95245260  0.56942313  0.58752849
   0.12824308  0.66472061  0.84793043
   0.56294782  0.70299520  0.58915853
   0.21559976  0.76693668  0.26782470
   0.56640076  0.58595015  0.52013729
   0.39234830  0.87322888  0.45430914
   0.18164419  0.63795680  0.47309925
   0.13705897  0.91588770  0.74781050
   0.78077845  0.10475850  0.22867333
   0.19873954  0.96408116  0.44338829
   0.78896780  0.61575428  0.87854943
   0.67982404  0.30887977  0.28042846
   0.74983793  0.44755155  0.50051416
   0.54939718  0.03550014  0.72135896
   0.80910310  0.77803837  0.99614043
   0.77711474  0.91488530  0.16187285
   0.79305623  0.16647447  0.13786842
   0.95008542  0.71818649  0.90605640
   0.03275587  0.12259133  0.78918573
   0.12209260  0.16682821  0.13633404
   0.33238236  0.00041465  0.56091400
   0.15199423  0.57267300  0.59783623
   0.74752673  0.08204739  0.38141978
   0.27064966  0.69951067  0.51215746
   0.05852428  0.85311595  0.30068409
   0.78462685  0.06638314  0.81753104
   0.94830872  0.89374377  0.75496810
   0.41933424  0.14455237  0.89998695
   0.41401433  0.24305627  0.21862542
   0.44842611  0.79785962  0.77454111
   0.71711941  0.02645649  0.73583015
   0.68487343  0.07713098  0.86617487
   0.03747811  0.11240894  0.09126161
   0.95740298  0.29403503  0.55482506
   0.51618419  0.89657110  0.03602072
   0.54966363  0.46876303  0.68768415
   0.26902531  0.83064733  0.97381044
   0.54702745  0.51236313  0.14373905
   0.67842434  0.89131501  0.40214058
   0.70021920  0.07932413  0.48393942
   0.23046506  0.51954975  0.42085136
   0.94826218  0.45496527  0.40857511
   0.99176434  0.82027500  0.93099537
   0.64725794  0.35399310  0.53605774
   0.19388739  0.06081632  0.77134044
   0.23756448  0.34989370  0.37679398
   0.19515459  0.11322102  0.97362537
   0.97997837  0.06416275  0.95017846
   0.97511942  0.98022426  0.41640295
   0.44378637  0.36063026  0.87588766
   0.27630252  0.45407501  0.01483579
   0.31244851  0.60023793  0.75518946
   0.48276211  0.94241922  0.62547724
   0.72207502  0.44780217  0.00372139
   0.60432346  0.96624987  0.94583365
   0.58631947  0.20372906  0.74597760
   0.03197924  0.85614980  0.03278800
   0.35188384  0.23342387  0.02787542
   0.97107374  0.59274122  0.39019757
   0.39130577  0.47351576  0.77502003
   0.61899069  0.58276556  0.81527724
   0.73075354  0.81059784  0.73656606
   0.37209533  0.38167231  0.30574376
   0.79305113  0.74838051  0.66733092
   0.05315741  0.44769762  0.81455327
   0.23152505  0.16534500  0.44245305
   0.43443963  0.10080723  0.08870753
   0.93655214  0.15557119  0.61156521
   0.31883369  0.62287202  0.21961028
   0.84085216  0.48716542  0.09500061
   0.71023586  0.93957825  0.55650944
   0.27758048  0.05042830  0.11361754
   0.68026255  0.17269893  0.12216560
   0.40945734  0.08726032  0.57568799
   0.67644651  0.31630715  0.91163129
   0.14627264  0.62304183  0.36995291
   0.65717302  0.48158385  0.91478660
   0.71343697  0.39403931  0.76233950
   0.57073131  0.87127027  0.60396483
   0.84599753  0.98910942  0.22415055
   0.78698708  0.60317801  0.59893673
   0.67402623  0.21227958  0.88861369
   0.09714429  0.76553128  0.36164497
   0.50745051  0.28079874  0.26786702
   0.55102807  0.95184094  0.79053463
   0.38537334  0.22253157  0.71879615
   0.65469029  0.71089444  0.31996138
   0.86883737  0.14976143  0.05661267
   0.00439915  0.50012377  0.68918344
   0.71062346  0.93503468  0.95429276
   0.00072244  0.47002064  0.56370117
   0.71169685  0.62013118  0.32399096
   0.35712392  0.43315830  0.87760858
   0.91573447  0.40048561  0.55588657
   0.63907461  0.14678603  0.60834542
   0.19481819  0.43141665  0.20248259
   0.37850758  0.21569266  0.36806276
   0.06706087  0.66366861  0.70412987
   0.34248073  0.34699914  0.02154198
   0.29393038  0.34823490  0.90976429
   0.51925221  0.08497949  0.25874608
   0.60667929  0.83744451  0.48551230
   0.03630656  0.76454393  0.47015961
   0.87788530  0.83040399  0.83768234
   0.66752575  0.72619142  0.89335220
   0.34776644  0.04315113  0.44854328
   0.13041584  0.28146349  0.13962457
   0.33614928  0.59911862  0.40773675
   0.13778765  0.52705456  0.31584191
   0.41776289  0.50431950  0.98844637
   0.12427635  0.58441975  0.04936384
   0.86790161  0.11849301  0.29712408
   0.68541297  0.34246839  0.01793051
   0.15066635  0.85002167  0.22733881
   0.67650727  0.62367557  0.73136537
   0.97245215  0.19306214  0.03375814
   0.72405582  0.10732024  0.97152072
   0.78585762  0.33044773  0.87842183
   0.44455030  0.74671500  0.67518359
   0.21425997  0.19395454  0.89759659
   0.89352831  0.05815997  0.69986986
   0.75285110  0.10671836  0.58002968
   0.90499232  0.38579663  0.94007987
   0.36892165  0.12906335  0.99404246
   0.63952448  0.32931715  0.43229822
   0.67486540  0.27096816  0.17507096
   0.61573905  0.33424403  0.10765409
   0.03487138  0.50287599  0.46479492
   0.45950526  0.36221894  0.03034229
   0.16538270  0.79009480  0.60300148
   0.64094376  0.62214876  0.91702768
   0.62541109  0.65580234  0.45772698
   0.82165858  0.03201737  0.61872717
   0.09332888  0.82616187  0.69280990
   0.19414920  0.31834889  0.21812585
   0.05838016  0.31316605  0.59869673
   0.08004911  0.44156238  0.21729550
   0.87732332  0.49485272  0.73302798
   0.13562391  0.34820176  0.05368645
   0.90441794  0.68555598  0.47459108
   0.86092649  0.73218538  0.08634936
   0.34807702  0.85301519  0.78550162
   0.23446878  0.65564972  0.69803940
   0.41511214  0.94493524  0.18347907
   0.67692043  0.76123893  0.41407116
   0.48277321  0.09502353  0.65688394
   0.75062873  0.19016698  0.35670000
   0.57157612  0.65170421  0.35933411
   0.29037386  0.03635449  0.67933881
   0.71443147  0.99661993  0.31886179
   0.97144326  0.68731087  0.10691146
   0.61307792  0.39570843  0.27884748
   0.34858509  0.09197258  0.26010808
   0.89042300  0.80822298  0.68345618
   0.33607790  0.87075866  0.22088052
   0.43546940  0.46312750  0.26475571
   0.97135331  0.73848109  0.55258812
   0.35182677  0.90176376  0.01357744
   0.76024353  0.39468341  0.64216605
   0.10285886  0.05253681  0.83757675
   0.40259303  0.32454941  0.39576188
   0.70300458  0.88826290  0.85619941
   0.79867177  0.71095412  0.46831927
   0.61840904  0.99066870  0.38366812
   0.88853155  0.55980059  0.15713529
   0.71723198  0.54598063  0.66381118
   0.23027097  0.51656700  0.53748116
   0.75044904  0.51460591  0.85766739
   0.45023895  0.57061337  0.80630067
   0.16884410  0.45941174  0.96254516
   0.05340075  0.20169723  0.70786405
   0.52461536  0.49022600  0.36785290
   0.08500135  0.79737007  0.86977552
   0.76896877  0.81544142  0.40791654
   0.58851653  0.59228587  0.20815471
   0.68211569  0.04772422  0.05521154
   0.92656059  0.38930352  0.21647759
   0.89438460  0.60174550  0.85731420
   0.09209957  0.86664193  0.46553718
   0.10270469  0.27898587  0.50307598
   0.54109101  0.91913000  0.35294128
   0.68291837  0.94958727  0.22485776
   0.59626565  0.09112844  0.34223496
   0.99268395  0.59701397  0.75493793
   0.19181825  0.11094770  0.20935697
   0.10392586  0.98088938  0.15291057
   0.20465593  0.51576088  0.87402896
   0.87932796  0.89412758  0.54404933
   0.94544071  0.27340520  0.10135394
   0.27490235  0.36971294  0.61112059
   0.55647877  0.30633205  0.77140161
   0.53066639  0.30529591  0.43117430
   0.29089572  0.16995646  0.20080588
   0.63679539  0.87764038  0.29831338
   0.01186251  0.34947583  0.94930006
   0.28516387  0.56829607  0.31260992
   0.61043452  0.81924384  0.86818459
   0.51320282  0.44866496  0.98543068
   0.05357476  0.66115994  0.42197418
   0.78807856  0.02067130  0.95165900
   0.75040943  0.73567668  0.82193218
   0.34435549  0.75756464  0.62255986
   0.54354752  0.30803316  0.88080150
   0.75274388  0.61725508  0.21947770
   0.58460859  0.00199100  0.05147454
   0.93949807  0.46509010  0.29766562
   0.81247392  0.87216253  0.63072276
   0.06650747  0.38910745  0.32213069
   0.95639051  0.14150784  0.87295227
   0.11499447  0.44648088  0.41230335
   0.04571207  0.22861973  0.31289968
   0.11640064  0.63232685  0.14768889
   0.03044126  0.12202145  0.51550062
   0.85812616  0.42073981  0.46369539
   0.65145042  0.24266233  0.36464437
   0.47691609  0.28181101  0.52590086
   0.58045358  0.51639458  0.04032972
   0.37550105  0.90688569  0.59913960
   0.21224699  0.14100496  0.07824325
   0.56797202  0.43281569  0.55739246
   0.75248239  0.95833794  0.65954361
   0.67285437  0.43814295  0.42021941
   0.31575797  0.36708019  0.45326232
   0.43692285  0.71731661  0.45741672
   0.48359754  0.94018097  0.44951785
   0.98539723  0.58269438  0.13183218
   0.94500994  0.48436893  0.82636391
   0.50493977  0.12236048  0.40165135
   0.80711592  0.98291537  0.51926036
   0.11829737  0.28916952  0.69007872
   0.63435760  0.29994858  0.63350305
   0.19788857  0.90782877  0.01636820
   0.83143032  0.16970431  0.52915534
   0.55581393  0.61239310  0.99028417
   0.28559868  0.05311964  0.34312300
   0.21984667  0.76736053  0.70275388
   0.46348599  0.58696521  0.92646989
   0.46730703  0.30376020  0.70494483
   0.39707351  0.78707352  0.26153523
   0.31679589  0.46565325  0.35170072
   0.12956487  0.74295464  0.96239528
   0.19237938  0.34409191  0.85284354
   0.28258187  0.66065616  0.84469241
   0.00343305  0.53983037  0.91996973
   0.33367730  0.70950441  0.41947785
   0.87801423  0.78467644  0.24605193
   0.41608342  0.52363544  0.53650317
   0.67170988  0.13481150  0.26320734
   0.83883444  0.74547879  0.89275862
   0.27834005  0.98261972  0.02701098
   0.43331978  0.15778964  0.28657583
   0.74411062  0.03437267  0.14771505
   0.04505287  0.34820239  0.17517571
   0.02630971  0.53300526  0.30946931
   0.38052524  0.45731734  0.16751659
   0.60435076  0.10979229  0.18299609
   0.09100765  0.41942558  0.59976906
   0.44355480  0.54852404  0.14922004
   0.71713697  0.22726036  0.62361684
   0.27043966  0.22488018  0.72987911
   0.87094106  0.16487881  0.72261017
   0.80527453  0.23221607  0.26462152
   0.90956754  0.37208974  0.82723531
   0.08888288  0.09190391  0.94152117
   0.85495330  0.98855731  0.78247139
   0.05007800  0.68691076  0.21966622
   0.42459863  0.87638294  0.09361223
   0.97193361  0.34513466  0.38629086
   0.87440326  0.07063853  0.48918392
   0.52684310  0.00391205  0.53506048
   0.84291434  0.65710899  0.16869922
   0.12545430  0.89436465  0.56905809
   0.55988757  0.57493537  0.63704293
   0.37761382  0.95672913  0.82726576
   0.80575583  0.93500781  0.31095325
   0.29946158  0.64971490  0.60973368
   0.62916746  0.16318346  0.49958072
   0.29726534  0.84948422  0.68613192
   0.22313206  0.41343239  0.76491198
   0.09211366  0.93539630  0.98650281
   0.87442845  0.58713841  0.66655901
   0.05529107  0.03493262  0.23671961
   0.36777732  0.46830779  0.45082605
   0.07257844  0.49732741  0.00465730
   0.25013451  0.81570418  0.53648916
   0.40754011  0.90119608  0.91846744
   0.36796815  0.19397815  0.12864774
   0.97459177  0.29254981  0.24945397
   0.86214721  0.53454695  0.26423732
   0.16131209  0.36024984  0.45919990
   0.14325326  0.02195873  0.64702720
   0.93639217  0.75566897  0.76958806
   0.76571412  0.20552186  0.72308742
   0.85338603  0.04526573  0.37508809
   0.78029130  0.66551508  0.74099604
   0.53225856  0.64274135  0.77795499
   0.19082584  0.41406544  0.55182601
   0.95699719  0.24192308  0.92906663
   0.46858049  0.25033313  0.01594066
   0.60258932  0.18652686  0.03862239
   0.63128303  0.99181661  0.49616027
   0.33080890  0.09434887  0.78022938
   0.17810562  0.58890260  0.22732548
   0.36069018  0.17587754  0.61993048
   0.79733646  0.23884776  0.44617866
   0.28423903  0.25967656  0.32545715
   0.89188049  0.65119091  0.76213123
   0.52219248  0.16661948  0.12270304
   0.17834247  0.07286064  0.47170731
   0.95647070  0.83682959  0.60025191
   0.90188452  0.22599368  0.19980873
   0.38086899  0.79454359  0.92768918
   0.79923567  0.43419129  0.92008403
   0.64603677  0.74238151  0.52887238
   0.91138421  0.04952672  0.04005480
   0.59736947  0.69574800  0.69819170
   0.70963084  0.83303417  0.59552580
   0.26574257  0.79188792  0.36703547
   0.47258689  0.71161005  0.84284524
   0.19811173  0.93904056  0.27415774
   0.85360636  0.32874803  0.39848047
   0.22876021  0.93969376  0.68301711
   0.69041166  0.54099977  0.05737742
   0.47751500  0.74062459  0.94968982
   0.73011795  0.61809988  0.98294332
   0.95231469  0.23805429  0.73570063
   0.44797790  0.41672265  0.69511920
   0.38342631  0.58392792  0.06559625
   0.43448850  0.98840656  0.72203092
   0.47895800  0.01759766  0.01810679
   0.87546516  0.30654137  0.69357433
   0.60245317  1.00020598  0.16371419
   0.22415107  0.32226149  0.69963673
   0.68349588  0.78931905  0.25156670
   0.53962663  0.22105480  0.35852065
   0.10279399  0.39012612  0.90083036
   0.55913613  0.05532325  0.89376362
   0.95160807  0.92600809  0.17334025
   0.29033070  0.05929697  0.95264200
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   0.46811654  0.63861162  0.63585780
   0.49717705  0.46227625  0.87725389
   0.12350026  0.00835179  0.31977393
   0.14003410  0.69225002  0.28585349
   0.37496994  0.04501502  0.16385874
   0.82753054  0.53552824  0.99680080
   0.67790228  0.47819995  0.31415501
   0.40658536  0.79294376  0.53084015
   0.52046405  0.78928986  0.41162089
   0.22750630  0.73093444  0.01310667
   0.38818789  0.64301425  0.86822817
   0.28542978  0.58885062  0.11578776
   0.18074304  0.80575290  0.44473826
   0.30978490  0.52473066  0.91492993
   0.52480850  0.27949293  0.15313024
   0.57735170  0.67840193  0.08620545
   0.22607349  0.61530625  0.02014808
   0.28159849  0.01202290  0.85353265
   0.75061990  0.70562026  0.56888680
   0.49798662  0.78867436  0.58882915
   0.76601058  0.49064718  0.74932154
   0.05439571  0.01715229  0.55062614
   0.59141942  0.15424875  0.93764953
   0.03131267  0.40358632  0.04353729
   0.04618649  0.97449419  0.88857232
   0.79416540  0.88898227  0.78888181
   0.84629456  0.88352091  0.01669904
   0.28450397  0.29462819  0.53220470
   0.60143403  0.55820843  0.31085277
   0.67020812  0.46511919  0.60401680
   0.43731726  0.12888787  0.75652580
   0.95745944  0.00565659  0.27514735
   0.20998849  0.69384063  0.12707584
   0.04024421  0.76848889  0.14712267
   0.18555599  0.09836674  0.31823734
   0.51571981  0.97491489  0.22697166
   0.32419939  0.30687158  0.23407170
   0.43046881  0.63525424  0.21835725
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   0.45885424  0.99687598  0.41497014
   0.33970538  0.33783964  0.25393781
   0.36446505  0.46491003  0.59887689
   0.75638769  0.48412491  0.21054912
   0.69744998  0.97272451  0.06467989
   0.73059209  0.92885206  0.09673649
   0.60981005  0.61981186  0.94207722
   0.95818831  0.63268674  0.00071469
   0.21792687  0.94470148  0.51042068
   0.62594764  0.98537302  0.45706558
   0.63861001  0.07921958  0.63909159
   0.60895030  0.03968414  0.67836321
   0.63178189  0.97879399  0.18044018
   0.53264249  0.21551576  0.62735600
