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=   161
   0.64202412  0.20202145  0.58313383
   0.08330320  0.61540883  0.51542863
   0.25369000  0.20161513  0.36102528
   0.41576418  0.02583258  0.55547725
   0.00749516  0.73451120  0.16290299
   0.73993711  0.82575002  0.36778567
   0.97249097  0.68227942  0.35977725
   0.49840238  0.92240806  0.75947941
   0.21502691  0.38461685  0.03260501
   0.39136235  0.73419183  0.55820246
   0.90866517  0.02025985  0.70869824
   0.43939638  0.15805595  0.87785944
   0.86808932  0.63070336  0.90631147
   0.18764003  0.01229649  0.37454502
   0.23577231  0.22267754  0.49319709
   0.85343589  0.78140912  0.02342990
   0.30102068  0.94687826  0.85565519
   0.51508782  0.34589715  0.23936767
   0.27770471  0.59004783  0.22250178
   0.11713797  0.84295379  0.60053259
   0.00561583  0.05661100  0.04471795
   0.45557722  0.94863430  0.36615200
   0.03856759  0.69367737  0.66978175
   0.66689721  0.22527051  0.22602054
   0.35018738  0.85019625  0.28456418
   0.85749641  0.11625629  0.87449061
   0.88890262  0.32185408  0.53163878
   0.36876022  0.58777110  0.97941809
   0.46815575  0.88069658  0.65652959
   0.78801050  0.62893880  0.34373301
   0.61930450  0.14717156  0.34474517
   0.89052442  0.18743439  0.40007975
   0.51477419  0.79584914  0.16362121
   0.92996811  0.95834382  0.13744799
   0.14319773  0.19144042  0.38115626
   0.02327518  0.63843550  0.83206286
   0.32206484  0.38144169  0.66262468
   0.29898328  0.11923951  0.90495363
   0.61463089  0.45739918  0.97234698
   0.68178491  0.75258968  0.19186105
   0.46964279  0.13443594  0.58870665
   0.97449408  0.77584527  0.70810759
   0.20008934  0.12508897  0.52741648
   0.73898309  0.17073788  0.79383496
   0.51115135  0.57797808  0.56840582
   0.29916419  0.40266351  0.35400695
   0.99581214  0.32983041  0.63043269
   0.40062179  0.57860081  0.79411997
   0.70404108  0.01770621  0.88753433
   0.21792153  0.46390596  0.84455479
   0.61105056  0.53900911  0.52884819
   0.59142538  0.42440722  0.70731577
   0.47339879  0.51340511  0.84777679
   0.12646167  0.74961710  0.76850233
   0.59615838  0.21400257  0.01949547
   0.84697329  0.79553466  0.37390006
   0.40741137  0.73488695  0.08801162
   0.95374409  0.83344867  0.23342930
   0.52167181  0.08454843  0.11458988
   0.26408873  0.79035864  0.83337258
   0.02499344  0.20210657  0.12252390
   0.92828683  0.41874025  0.65518603
   0.88354798  0.57488479  0.08680313
   0.54280571  0.64283534  0.45265629
   0.84317418  0.75269581  0.53238658
   0.18055829  0.44848881  0.73834957
   0.84479540  0.63238383  0.44943300
   0.29286481  0.02017939  0.40500723
   0.33594897  0.41794450  0.92886941
   0.48684031  0.70944719  0.28277387
   0.11975627  0.91307918  0.23804843
   0.31603108  0.12702464  0.18574179
   0.30389634  0.73036259  0.35646964
   0.32864178  0.39706745  0.77343939
   0.53597543  0.23346559  0.60783081
   0.90859888  0.26768374  0.74464661
   0.25747599  0.59906686  0.58436200
   0.56663085  0.46299462  0.80741753
   0.59959686  0.47975009  0.34203812
   0.68893160  0.87801415  0.51225153
   0.99619406  0.51363746  0.66682838
   0.71767687  0.44049740  0.13215233
   0.46231376  0.22141348  0.74587918
   0.32072730  0.11853554  0.07495196
   0.55875790  0.44949285  0.24112951
   0.95128739  0.92856124  0.28634541
   0.03376647  0.98937543  0.24006725
   0.59100692  0.77812474  0.24519258
   0.84711004  0.02265740  0.39183577
   0.78923774  0.37220830  0.27451586
   0.83018985  0.73841764  0.12063057
   0.28410514  0.85568755  0.59518200
   0.67450123  0.58336781  0.44615619
   0.24195426  0.98456099  0.09391257
   0.95025754  0.52468679  0.37977511
   0.33371758  0.18580946  0.98773172
   0.44225742  0.65664779  0.61866064
   0.19932222  0.78855447  0.53803475
   0.39913289  0.44105791  0.01929728
   0.40386697  0.26467041  0.45592176
   0.08668903  0.26974771  0.93600019
   0.60716861  0.28895013  0.10302148
   0.99427324  0.12968320  0.64248634
   0.75770557  0.30538787  0.47235901
   0.68580268  0.72361626  0.67015141
   0.46397367  0.34914581  0.01716367
   0.47611718  0.13503891  0.48071162
   0.60844789  0.46467371  0.14258481
   0.84517756  0.35317673  0.70291288
   0.16215046  0.33972476  0.36832156
   0.23163676  0.32920668  0.53667412
   0.99577959  0.50724521  0.54842329
   0.76952750  0.09661437  0.41136374
   0.22608049  0.27822397  0.20126612
   0.25544645  0.65387804  0.08341521
   0.67904607  0.65890878  0.36246199
   0.69157010  0.87537213  0.04222047
   0.27874035  0.37772821  0.18496362
   0.49884147  0.03750018  0.41914399
   0.50939517  0.40268681  0.63190147
   0.14363213  0.73963032  0.03263544
   0.54526513  0.23463979  0.34254618
   0.79025456  0.19871588  0.34700615
   0.52637395  0.39432064  0.93996145
   0.32109334  0.02490308  0.78207084
   0.54845280  0.21789989  0.45330360
   0.36318962  0.16612967  0.61016588
   0.81124234  0.46290158  0.20327953
   0.12725105  0.66941337  0.12356089
   0.85076699  0.19446284  0.11371009
   0.19119395  0.11409221  0.64275471
   0.26159944  0.30943982  0.40021222
   0.68240246  0.75049630  0.42742777
   0.69115903  0.11259620  0.94496012
   0.82234249  0.74017787  0.74897028
   0.60624956  0.35310540  0.58024703
   0.93078691  0.42571412  0.50648713
   0.13996217  0.65423175  0.68326872
   0.84476211  0.96395214  0.77769600
   0.76820097  0.24381161  0.17097227
   0.81297034  1.00261098  0.55958829
   0.18285364  0.55084928  0.17997475
   0.63788962  0.77533719  0.55641197
   0.92096243  0.84364787  0.63859362
   0.30859931  0.94265847  0.70840007
   0.63039963  0.73738168  0.93847561
   0.85510963  0.36381063  0.09802972
   0.08296761  0.33037880  0.55855035
   0.67879027  0.54583886  0.71230362
   0.43478250  0.00883595  0.17738836
  -0.00005834  0.29728372  0.32092733
   0.65876053  0.61229931  0.07510849
   0.36875433  0.44623858  0.13600088
   0.43541296  0.94938926  0.06265238
   0.19150652  0.94605150  0.73593698
   0.45599903  0.49643875  0.21371578
   0.74130729  0.66730356  0.48897622
   0.82749413  0.27527378  0.94853372
   0.39433823  0.27569653  0.10086317
   0.09323856  0.47096306  0.49858433
   0.90450785  0.68455175  0.70141540
   0.40106395  0.96875693  0.64585516
   0.53393729  0.64851970  0.80821703
   0.10989110  0.13582441  0.16033724
   0.70258732  0.24551234  0.99520780
   0.00076742  0.76915517  0.49565910
   0.23593388  0.82038430  0.69213307
   0.28601369  0.69444721  0.77422884
   0.94705711  0.22694589  0.64895779
   0.23880384  0.60307945  0.82269750
   0.17035433  0.23043424  0.11704875
   0.04097131  0.81590622  0.79012846
   0.72450290  0.57683999  0.16818710
   0.29336933  0.54301870  0.67910241
   0.84205820  0.81823603  0.20133790
   0.86000805  0.90075241  0.34550674
   0.42923104  0.24320450  0.99633537
   0.32228009  0.01338608  0.16939941
   0.71625646  0.71720095  0.77492821
   0.04180793  0.18924144  0.87139796
   0.69939510  0.33167459  0.15449085
   0.35641892  0.84151460  0.13430567
   0.38154291  0.68628834  0.83310905
   0.40461206  0.14294284  0.32382335
   0.12602450  0.60424750  0.78145757
   0.16411784  0.93003003  0.93985964
   0.03477343  0.13823208  0.44913130
   0.99936367  0.30528014  0.13963469
   0.85924371  0.86632691  0.53168604
   0.03633878  0.16026519  0.01993143
   0.21151475  0.26177866  0.89555597
   0.53705742  0.33859690  0.77735123
   0.31101976  0.51206615  0.78971774
   0.39208259  0.62009248  0.08010510
   0.77934583  0.21032035  0.54568210
   0.40156038  0.57492416  0.68337589
   0.23835045  0.69082497  0.18502504
   0.24673135  0.48684431  0.06229031
   0.28905872  0.51325056  0.96255546
   0.06326512  0.06675095  0.31594753
   0.17543463  0.40175025  0.92305636
   0.48027777  0.78564585  0.50191842
   0.13336895  0.99514998  0.10446007
   0.68727427  0.02877510  0.02300407
   0.73003065  0.76144129  0.87918001
   0.70723262  0.92547653  0.79054370
   0.02239657  0.56483886  0.23150134
   0.69240374  0.26595484  0.72074542
   0.98839010  0.45534414  0.22225568
   0.17507443  0.84776510  0.79757916
   0.10895183  0.52126643  0.68959843
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   0.09265895  0.36643291  0.45292807
   0.98630742  0.36987626  0.42613885
   0.93365440  0.38501530  0.28918236
   0.27255137  0.25639965  0.71879374
   0.61527215  0.80558426  0.79122624
   0.66340711  0.05339791  0.49538287
   0.44830730  0.47894036  0.43997595
   0.35005475  0.02344930  0.92765469
   0.78505317  0.98077390  0.98300391
   0.83612302  0.56665818  0.26201459
   0.14778591  0.57665334  0.60122224
   0.34779614  0.92690479  0.37075118
   0.48634344  0.73343809  0.00774228
   0.15858676  0.59236139  0.35591294
   0.70047227  0.43968845  0.68566166
   0.68635200  0.32711301  0.26812949
   0.53822553  0.06909649  0.65133837
   0.69701320  0.55776106  0.60114060
   0.50612537  0.97873229  0.51237981
   0.56317732  0.83237814  0.07415548
   0.74708060  0.79767585  0.57040509
   0.86194782  0.47676511  0.43523927
   0.43517345  0.24026631  0.35188763
   0.28433607  0.12966600  0.79264983
   0.24677892  0.83843254  0.17797727
   0.44803613  0.91998050  0.85631266
   0.64045650  0.65012020  0.19171849
   0.23483709  0.22736990  0.02606198
   0.33946827  0.86097059  0.46051848
   0.47902912  0.97180649  0.95840761
   0.43218021  0.66678640  0.43868505
   0.05031614  0.34831817  0.22874818
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   0.42319696  0.47630134  0.32237478
   0.60413104  0.03185362  0.83404223
   0.12164259  0.61293635  0.25246632
   0.74172209  0.87078223  0.88427776
   0.19506588  0.43866457  0.54008645
   0.24599638  0.89585017  0.00962608
   0.89714643  0.57253530  0.53966591
   0.29285029  0.80169517  0.94428198
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   0.12067762  0.49962668  0.92408811
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   0.10225578  0.01551480  0.61660449
   0.61528208  0.61966230  0.90355183
   0.79883336  0.96890777  0.17606118
   0.81597332  0.02810125  0.19468161
   0.26321829  0.30589771  0.43932825
   0.19012401  0.47258466  0.42454015
   0.17430236  0.14811029  0.93655341
   0.36611717  0.42650174  0.62164903
   0.90634290  0.17592577  0.85044509
   0.92743183  0.22569545  0.81831506
   0.64355662  0.91036866  0.16626591
   0.57803238  0.14407962  0.76100657
