1999
XYZ file for : NL9901 in space group P2(1)/c
  F       41.87001       -4.67134       -7.24058
  F      -43.34721       -4.01924       -6.96143
  F       39.25405       -4.24259       -7.48066
  I      -48.47286        2.73774       -5.98784
  F      -40.81525       -3.24330       -6.69340
  I       35.11843      -11.68293       -6.83648
  C       41.05532       -5.08919       -6.25315
  C       39.71595       -4.82307       -6.37747
  I       38.62212       -8.91315       -6.41330
  F      -31.19060       -9.16250       -7.15420
  I      -44.61747        0.46421       -5.68168
  C      -42.96676       -3.43184       -5.83115
  F      -32.35737        7.56938       -6.76599
  F       27.09744        0.90067       -7.28789
  F       25.93067       17.63254       -6.89968
  F       28.46262       18.40849       -6.63165
  S      -45.59551       -3.56536       -5.14983
  C      -41.67685       -2.98853       -5.69036
  F       29.62939        1.67661       -7.01986
  F      -28.57464       -9.59125       -6.91412
  I       37.45535        7.81873       -6.02509
  I       33.95166        5.04894       -6.44827
  H      -47.97306       -4.77373       -4.58683
  I      -36.49299        0.12903       -6.12181
  S       43.28426       -6.19062       -5.08292
  F      -29.74141        7.14062       -6.52591
 Co      -46.59389        1.69432       -4.57020
  C       41.57098       -5.71608       -5.16326
  S       37.09629       -5.08709       -5.69918
  C      -43.91345       -3.20990       -4.82893
  F       15.77250       -5.88256       -7.37184
  H      -49.29133        0.31537       -3.99718
  C       38.81243       -5.22021       -5.38961
  I       26.99394      -11.34776       -6.39635
  F       18.38847       -6.31131       -7.13176
  F      -19.86566       -2.37927       -7.07025
  F      -21.03243       14.35260       -6.68204
  C      -30.72871       -9.74298       -6.05101
  I       23.13856       -9.07422       -6.70252
 Co       36.83905      -10.45550       -5.36614
  I      -23.82454      -12.35416       -6.48488
  C      -47.38622       -5.14416       -3.96843
  F       14.60573       10.84932       -6.98363
  F       -7.70905       -7.52253       -7.26302
  C      -29.38933      -10.00910       -5.92669
  H       42.72260       -3.39911       -4.55327
  I      -32.98930        2.89882       -5.69863
  F       17.22169       10.42056       -6.74355
  C       26.31112       18.21994       -5.76939
  C       27.60102       18.66326       -5.62861
  C       27.47789        1.48807       -6.15761
  C      -31.89548        6.98889       -5.66280
  C      -42.41640       14.38473       -4.18284
  C       28.76779        1.93138       -6.01682
  H      -47.02862        4.61053       -3.81345
  C      -46.06210       -4.74613       -3.94856
  F      -18.50047       15.12854       -6.41401
  F      -17.33370       -1.60333       -6.80222
  S      -33.34836      -10.00700       -5.37272
  C      -41.24963       -2.34714       -4.57105
  I       11.63688      -13.32290       -6.72766
  F        3.61589       -0.73930       -7.17907
  F        2.44912       15.99257       -6.79086
  I      -11.84467      -14.96287       -6.61884
  C       43.97084       -4.88369       -4.10010
  F       -5.09308       -7.95128       -7.02294
  I       21.97179        7.65766       -6.31430
  H       36.81549      -13.43561       -4.74621
  I      -19.96916      -14.62770       -6.17871
  F       -8.87582        9.20935       -6.87481
  I      -24.99131        4.37772       -6.09666
  I       25.82717        5.38412       -6.00814
  C      -48.72772       -0.06881       -3.36347
  F       42.42844      -15.00497       -3.90657
  C      -30.55610        6.72277       -5.53848
  S      -40.78526       15.08812       -4.07517
  C       43.47212       -3.62596       -4.05169
 Co       35.67228        6.27637       -4.97793
  F        4.98107       16.76851       -6.52283
  H       34.57594       -4.24749       -5.08866
  F        6.14785        0.03664       -6.91104
  S      -39.61849       -1.64375       -4.46338
  S      -34.51513        6.72487       -4.98451
  H      -48.72389       -6.29995       -3.12672
  H      -35.86871       -9.16740       -4.76221
  N      -47.43562        0.30645       -3.32844
  I       15.14057      -10.55312       -6.30448
  C       40.71618       -6.08151       -4.16308
  F       -6.25986        8.78059       -6.63473
  C      -31.63222      -10.14012       -5.06316
  I       -0.34299      -10.71419       -6.59370
  N       37.88929      -11.83690       -4.29974
  C       39.34674       -5.83629       -4.27459
  C      -47.82635       -6.06473       -3.09956
  C       16.23439       -6.46304       -6.26865
  C       37.55687      -13.15292       -4.26155
  N      -45.74199        3.15734       -3.43780
  C      -46.25364        4.41134       -3.33998
  H       45.50544       -6.04575       -3.41810
  C       17.57377       -6.72916       -6.14433
  H       33.97826       -9.49200       -4.73878
  C      -43.46618       -2.57778       -3.68494
  C       45.13188       -5.19459       -3.37913
  H      -37.03549        7.56448       -4.37399
  H      -39.78579       -4.50762       -4.06495
  I        3.51239      -12.98773       -6.28753
  C      -20.65198       14.94000       -5.55176
  C       36.47429       -4.03918       -4.44620
 Co      -34.77237        1.35646       -4.65147
  H      -40.95256       12.22425       -3.67674
  C      -19.48521       -1.79187       -5.93997
  I       -8.34098      -12.19309       -6.19566
  I       10.47011        3.40897       -6.33945
  I      -13.01144        1.76900       -6.23063
  I      -21.13593        2.10418       -5.79050
  S       23.68237       18.08643       -5.08808
  S       24.84914        1.35456       -5.47629
  C      -32.79900        6.59175       -4.67494
 Co       25.01754      -10.11764       -5.28487
  S       29.65938       20.00803       -4.40163
  C       35.10770       -3.82818       -4.45194
  C       15.06762       10.26883       -5.88044
  C      -19.36208       15.38332       -5.41097
  H       35.64872        3.29626       -4.35799
  C      -42.14363       -2.15038       -3.55782
  C       -7.24716       -8.10301       -6.15983
  C       16.40700       10.00272       -5.75612
  C       28.02825       19.30464       -4.50929
  C       44.08123       -2.69176       -3.26024
  C      -28.87367      -10.63599       -4.83680
  C      -18.19530       -1.34856       -5.79918
  C      -49.24054       -0.99779       -2.49553
  C       25.36443       18.44189       -4.76717
  S       30.82615        3.27616       -4.78984
  C      -45.23572       -5.36264       -3.02468
  I       13.97380        6.17876       -5.91627
  F       43.76621        2.54483       -3.25693
  I       -1.50976        6.01768       -6.20548
  C       26.53120        1.71001       -5.15538
  H      -37.63316        2.31997       -4.02411
  C       29.19502        2.57277       -4.89751
  H       43.72066       -1.83449       -3.22776
  N       35.81694       -9.25662       -4.06437
  C      -35.33696       -8.74809       -4.12548
  C       -5.90778       -8.36913       -6.03551
  F       41.26167        1.72691       -3.51835
  H       38.01006      -14.97664       -3.54383
  C       38.26181      -14.08100       -3.54227
  C       38.95472      -11.45383       -3.54213
  H      -44.33152       -5.14723       -2.99326
  H       32.81149        7.23988       -4.35057
  H       39.19278      -10.55426       -3.53385
  C       44.68566        5.56209       -2.93081
  S      -27.16039      -11.11053       -4.75646
  C        2.82957       16.57997       -5.66057
 Co      -21.94556      -13.39758       -5.06723
  C       34.48517       -9.06301       -4.08620
  C        3.99634       -0.15190       -6.04879
  N       36.72252        4.89497       -3.91153
  S      -23.28074       14.80649       -4.87044
  C      -33.97036       -8.95909       -4.11974
  S      -22.11397       -1.92539       -5.25865
  C       44.08289      -13.95464       -2.65877
  C        4.11947       17.02329       -5.51979
  C       -8.41393        8.62886       -5.77162
  C       42.76035      -14.38204       -2.78589
  I       -9.50775        4.53879       -5.80745
  C      -39.07337       -4.20240       -3.55102
  C       36.39009        3.57896       -3.87333
  C      -39.92087       13.84511       -3.15151
  C      -40.24014       12.52948       -3.16281
  C        5.28624        0.29141       -5.90800
  S       13.61474       -6.72706       -5.59036
  H      -46.05550        6.24521       -2.53739
  H      -34.79594       -1.62365       -4.03154
  C      -36.50373        7.98379       -3.73727
  I        2.34562        3.74415       -5.89932
  C       45.70358       -4.21189       -2.61552
  C      -30.04044        6.09588       -4.44859
  C      -38.75410       -2.88676       -3.53972
  C      -45.68194        5.39404       -2.57636
  H       30.65886        0.41229       -4.39141
 Co       23.85077        6.61423       -4.89666
  C      -46.64992       -0.29570       -2.42066
  C      -44.63130        2.89122       -2.69526
  C       -7.07455        8.36275       -5.64730
  H      -44.27072        2.03395       -2.72773
  F       41.13490       -6.70343       -3.07128
  F      -44.31628       -2.34537       -2.69856
  H      -24.64301      -14.77654       -4.49422
  H       38.13556       -3.44641       -3.46784
 Co       13.35750      -12.09547       -5.25732
  C      -35.13713        7.77279       -3.73153
  N      -47.04065       -6.66688       -2.19178
  N       45.19194       -2.95789       -2.51770
  S       -9.86681       -8.36703       -5.48154
  C       15.33088       -6.86018       -5.28079
  H       22.47159        0.14618       -4.91329
  H       22.32009      -11.49660       -4.71185
  F       38.54028       -6.22965       -3.30273
  F      -41.68496        6.90289       -2.88422
  H      -45.75237       -0.06047       -2.39350
  C       37.21012       -3.35730       -3.49220
  S       19.80271       -7.83059       -4.97410
  H       21.30482       16.87805       -4.52508
  S      -28.32716        5.62135       -4.36825
  C       18.08944       -7.35605       -5.05444
  H      -24.49151       -3.13376       -4.69565
  N       34.65017        7.47525       -3.67615
  C      -31.09791      -10.75620       -3.94813
  C      -21.59867       15.16195       -4.54953
  H      -25.65828       13.59811       -4.30744
 Co      -10.12405      -13.73545       -5.14850
  S       12.44797       10.00481       -5.20215
  C      -20.43190       -1.56993       -4.93774
  H       46.47856       -4.41107       -2.14204
  H       24.58280       -7.20144       -4.52813
  C      -37.12626        2.74896       -3.37153
  H      -27.72205       -8.31902       -4.22681
  C       39.37081      -13.64566       -2.80399
  C       33.31839        7.66887       -3.69799
 Co      -23.11234        3.33429       -4.67902
  C      -45.74854       -6.29161       -2.15675
  C       39.69007      -12.33003       -2.79269
  C       30.52377       18.76502       -3.47797
  C       46.83616        5.34362       -1.98707
  H       38.02601        6.17762       -3.14564
  H      -36.81931       -7.82912       -3.23563
  C       31.69054        2.03315       -3.86618
  C       37.78795        5.27804       -3.15392
  F      -28.01621      -19.92488       -3.58011
  C       34.54693       -3.01866       -3.54293
  H       37.43601       -8.70330       -3.10808
  C       31.37128        0.71752       -3.87748
  C      -29.72847      -11.00142       -3.83662
  S        0.20081       16.44646       -4.97926
 Co        1.53599      -11.75761       -5.17605
  S      -11.03358        8.36484       -5.09333
  C       -8.15067       -8.50015       -5.17197
  N      -35.79449        2.55534       -3.34970
  C      -34.05456       -1.34095       -3.54688
  N      -33.72213       -0.02494       -3.58507
  S        1.36759       -0.28542       -5.36747
  C       14.16410        9.87170       -4.89258
  H       33.62535       -2.90921       -3.56209
  C      -35.89772       -7.93857       -3.21647
  C       36.51443       -8.59385       -3.12724
  C       37.09504        2.65088       -3.15406
  N       25.86942       -8.65462       -4.15247
  C       45.51204        4.94558       -2.00694
  H       36.84329        1.75524       -3.15561
  H       13.33394      -15.07558       -4.63739
  H      -22.38030      -10.48138       -4.31049
  H      -28.88882        8.41285       -3.83860
  C      -18.93485       16.02470       -4.29166
  S       18.63594        8.90129       -4.58589
  C       16.92266        9.37582       -4.66623
  C      -32.26469        5.97568       -3.55992
  C       27.13424       19.50141       -3.49607
  H      -37.98608        8.90275       -2.84742
  C       25.81170       19.07400       -3.62319
  H       11.09438       -5.88746       -4.97984
  H      -38.57607       -5.97816       -2.80986
  C       24.38255        0.17379       -4.27501
  H      -12.38717       -7.52743       -4.87103
  F      -41.81173       -1.52745       -2.43714
  C       42.91612        2.77724       -2.27056
  C       23.21578       16.90566       -3.88680
  C      -17.76808       -0.70717       -4.67987
  N       24.17581      -11.50551       -4.04311
  C       26.97847        2.34213       -4.01140
  H      -25.80978        1.95534       -4.10600
  C      -38.33801       -5.07859       -2.80157
  C       28.30101        2.76953       -3.88428
  C       25.35778       -7.40062       -4.05465
  H       23.41603        9.53044       -4.13991
 Co       12.19073        4.63640       -4.86911
  C      -24.07940      -15.16072       -3.86050
  C       41.59357        2.34984       -2.39768
  C       23.05843       -0.22425       -4.29489
  H      -10.14761      -16.71555       -4.52857
  F      -39.09034        6.42911       -2.65277
  C       22.88371      -11.88078       -4.07814
  C       -5.39211       -8.99602       -4.94562
  H      -38.56013       15.17610       -2.41167
  C      -37.06449        8.79330       -2.82826
  C      -38.81187       14.28045       -2.41323
  C        1.88288       16.80192       -4.65835
  S      -17.30372       16.72809       -4.18399
  H      -39.74285       10.75371       -2.42165
  C       33.85123       -8.25521       -3.17796
  C       21.89166       16.50762       -3.90667
  C      -39.50478       11.65329       -2.41336
  H       40.40250      -12.02480       -2.27876
  F       32.52108       -5.38286       -3.36744
  H       21.15331        5.23528       -4.32364
  H       19.24105       -5.03908       -4.44445
  C        3.04965        0.07004       -5.04656
  C      -47.09004       -1.21626       -1.55179
  F       29.92646       -4.90908       -3.59889
  C      -37.64510       -2.45142       -2.80144
  H      -12.98485      -12.77194       -4.52114
  S       -3.67884       -9.47056       -4.86528
  C      -26.47382       -9.80360       -3.77364
  C       -9.31745        8.23172       -4.78376
  C      -44.52090        5.08314       -1.85540
  H       32.92580       -8.16610       -3.20233
  C      -33.23452       -8.27721       -3.16574
  H      -37.39335       -1.55578       -2.79988
  C      -30.89524        5.73046       -3.44841
  H       10.49671      -11.13197       -4.62996
  C      -23.90467       -3.50419       -4.07725
  N      -22.78730      -14.78545       -3.82547
  C      -26.97253       -8.54587       -3.72523
  C      -44.02218        3.82541       -1.90381
  S      -16.13694       -0.00378       -4.57220
 Co      -11.29082        2.99643       -4.76029
  C      -25.07145       13.22768       -3.68904
  H        9.92761       10.84441       -4.59163
  C        4.54670       17.66467       -4.40048
  F      -25.51167      -19.10696       -3.31869
  H      -13.55394        9.20444       -4.48281
  H      -32.30909       -8.36632       -3.14138
  H       36.26924        8.02858       -2.71987
  S        6.17783       18.36806       -4.29281
  H       -1.16146      -13.13657       -4.60303
  C      -22.58055       -3.10616       -4.05738
  H      -38.68562        3.64587       -2.48765
  H       33.05129        3.36413       -3.12634
  N      -21.09368      -11.93456       -3.93483
  C       41.86634      -14.18528       -1.77266
  H      -23.54707        6.25050       -3.92227
  C      -23.74732       13.62572       -3.66916
  C        5.71347        0.93280       -4.78869
  C       32.79955        2.46849       -3.12790
  N       24.70265        8.07725       -3.76426
 Co        0.36921        4.97426       -4.78784
  H      -45.18493       -6.67579       -1.52303
  C       35.34766        8.13803       -2.73902
  H       -1.00996       -1.49379       -4.80447
  C       14.07531      -14.79289       -4.15273
  N       14.40774      -13.47687       -4.19092
  F       18.94689      -16.64494       -3.79775
  H       -2.17673       15.23808       -4.41626
  H       18.07428       11.69279       -4.05624
  S       40.23520      -14.88867       -1.88033
  F      -31.90437      -11.14956       -2.97627
  C       38.52330        4.40185       -2.40448
  S        7.34460        1.63619       -4.68102
  H       27.34070       -9.77802       -3.44241
  C      -34.40130        8.45467       -2.77753
  C       32.10664       -0.15868       -3.12803
  C      -21.60532      -10.68056       -3.83701
  H       31.86858       -1.05825       -3.13632
 Co       46.04382       -1.49487       -1.38530
  F       28.75969       11.82280       -3.21068
  C       38.20404        3.08622       -2.41578
  C      -37.76019        3.55675       -2.46329
  F       31.35431       11.34902       -2.97923
  C       24.19101        9.33125       -3.66643
  C       -6.55889        7.73585       -4.55741
  C       20.48929       -6.52366       -3.99128
  C       36.57619       -2.54950       -2.58397
  C      -28.13930        8.18601       -3.33702
  C       26.98013       -8.92075       -3.40993
  C      -27.64059        6.92828       -3.38543
  F       21.45143      -15.82702       -3.53633
  C       12.99274       -5.67915       -4.33738
  C       15.86519       -7.47626       -4.16577
  H      -33.47586        8.36555       -2.75317
  H      -33.60136       -3.16467       -2.82916
  C       17.23463       -7.72148       -4.05426
  C       19.99057       -5.26593       -3.94287
  C       -9.40624      -16.43286       -4.04391
  H      -16.30424       -2.86765       -4.17377
  C       11.62615       -5.46815       -4.34312
  S       -4.84561        7.26132       -4.47707
  C      -33.34961       -2.26903       -2.82760
  C       32.68446        8.47666       -2.78975
  N       35.24442       -2.35589       -2.60580
  N       -9.07381      -15.11684       -4.08210
  H      -17.47101       13.86422       -3.78555
  F      -29.18298       -3.19300       -3.19190
  H        1.10125       -8.84141       -4.41931
  C      -31.07384      -18.56557       -2.47753
  C      -41.26624        6.28097       -1.79242
  C      -11.85540       -7.10812       -4.23430
  N       23.00903        5.22636       -3.65490
  H       31.75903        8.56578       -2.81411
  C      -32.65670        0.35813       -2.82746
  C      -21.15140       15.79406       -3.40555
  H       12.16717        1.65629       -4.24917
  C      -10.48881       -7.31912       -4.22856
  C      -25.24617        1.57116       -3.47229
  H      -32.41864        1.25771       -2.81918
  H      -14.15162        3.95994       -4.13293
  C       21.71693        4.85110       -3.68993
  H      -25.49642      -16.30510       -3.02399
  H       -4.24050       -6.67905       -4.33563
  H        9.32993        5.59991       -4.24175
  C      -19.98463       -0.93781       -3.79376
  C       25.92948       -6.41792       -3.29103
  H       26.11312       -0.22732       -3.31972
  H       25.85905      -11.87244       -3.10817
  N       12.33539      -10.89659       -3.95555
  H      -43.27266        3.59857       -1.40222
  C      -35.09699        3.21812       -2.41257
  H        7.17731       -1.22768       -4.28259
  N      -22.26045        4.79731       -3.54662
  F      -33.07114        5.58231       -2.58806
  C       11.82597       11.05273       -3.94917
  H       39.23573        4.70708       -1.89055
  C       19.32251       10.20822       -3.60307
  C       35.95366       -7.78433       -2.21823
  C      -24.59222      -16.08969       -2.99256
  C      -12.47794      -12.34295       -3.86856
  C       25.20892       -0.44273       -3.35114
  C       24.96150      -12.10767       -3.13533
  C       11.00362      -10.70298       -3.97738
  N      -23.95407        1.94642       -3.43726
  H       24.94635       16.50455       -2.93151
  H      -11.31439        0.01632       -4.14035
  H       25.55593       -5.56675       -3.25206
  H        6.01054       15.50419       -3.89437
  C       10.45938       11.26373       -3.95491
  C      -22.77209        6.05131       -3.44880
  C       18.82380       11.46595       -3.55466
  N      -35.20023       -7.27580       -2.27934
  F      -29.30975      -11.62334       -2.74482
  C      -19.82886       16.22147       -3.27843
  C       24.04215       16.28915       -2.96293
  N      -11.14616      -12.53656       -3.84673
  C       -7.61636       -9.11623       -4.05695
  H      -25.24234       -4.65998       -3.23554
  N      -37.27259       -4.69552       -2.04397
  C      -38.10693       13.35237       -1.69395
  H      -24.93921      -10.96566       -3.09164
  C      -13.02217        9.62376       -3.84609
  C       -0.59785      -13.52075       -3.96932
  C       22.37088      -12.80975       -3.21020
  C      -27.68430      -19.30195       -2.45943
  C      -36.94016       -3.37950       -2.08216
  C      -39.89680        6.03574       -1.68091
  C       14.69841        9.25562       -3.77756
  H      -34.17541        3.10867       -2.39341
  F       -4.53466      -18.28491       -3.68893
  H       -2.32823        3.59531       -4.21482
  H       21.46668      -13.02516       -3.24163
  C       22.61831       -1.14481       -3.42602
  C      -25.31277      -10.11450       -3.05267
  N        2.38787      -10.29459       -4.04365
  N      -38.43936       12.03636       -1.65576
  C      -18.66209       -0.51041       -3.66664
  H       26.17393        6.95386       -3.05419
  F       24.96160       19.30641       -2.63681
  N        0.69425      -13.14548       -3.93429
  F       27.46615       20.12434       -2.37539
  C       34.58707       -7.57333       -2.22397
  H       14.52851      -16.61661       -3.43501
  C       16.06786        9.01040       -3.66604
  H       21.72076       -1.38004       -3.45317
  C      -11.65558        9.41276       -3.84035
  F       42.56150       -4.76111       -1.29332
  C       -0.42312       -1.86422       -4.18607
  C       33.50450        1.54041       -2.40862
  H      -26.40911       12.07189       -2.84732
  C      -24.34479       -4.42476       -3.20838
  C        0.90100       -1.46618       -4.16619
  C       25.81335        7.81113       -3.02171
  C       14.78026      -15.72097       -3.43345
  H       22.02388       -7.68573       -3.30928
  C      -33.86846       -7.46941       -2.25751
  H       -5.40727       10.05282       -3.94742
  C       -1.58989       14.86765       -3.79786
  C       21.45153       15.58706       -3.03781
  C       -0.26577       15.26569       -3.77798
  C       -6.24692       -9.36145       -3.94544
  H       -0.06552        7.89047       -4.03109
  N      -36.36700        9.45608       -1.89113
  C      -26.36342       -7.61167       -2.93378
  C       43.36338        3.40936       -1.12657
  F       26.12838        2.57454       -3.02502
  H       37.08310       -2.12051       -1.93139
  N       33.17207        0.22439       -2.37043
  H       20.55398       15.35183       -3.06496
  H      -19.62240      -13.05796       -3.22477
  H      -26.72399       -6.75440       -2.90130
  N       13.24097        3.25500       -3.80271
  C      -25.51156       12.30712       -2.82017
  F       39.94553       -4.33236       -1.53340
  C       21.65033       -6.83456       -3.27031
  C       15.47317      -13.09380       -3.43331
  C        1.87623       -9.04059       -3.94583
  F       28.63292        3.39246       -2.76360
  C      -16.43933       15.48508       -3.26033
  F      -26.67843       -2.37508       -2.93048
  C      -19.98298      -12.20069       -3.19229
  C      -22.00160      -15.38761       -2.91769
  C      -15.59182       -2.56242       -3.65984
  H       15.71123      -12.19423       -3.42503
  S       45.04545        3.76481       -0.80567
  C       24.76271       10.31395       -2.90282
  C       31.71462       -5.77622       -2.39558
  C       12.90854        1.93899       -3.76451
  C      -16.75859       14.16945       -3.27162
  C      -15.27255       -1.24679       -3.64854
  C       40.69957        2.54660       -1.38445
  C       30.34518       -5.53100       -2.50709
  C        2.33015       17.43403       -3.51437
  C       -2.99226       -8.16363       -3.88246
  H       24.38915       11.16512       -2.86385
  C      -26.36176      -18.87455       -2.33231
  H       -8.95304      -18.25658       -3.32619
  S      -43.83432        6.39007       -0.87257
  H      -21.10405      -15.15238       -2.89053
  F      -17.03664       -8.18902       -3.38125
  C      -35.03523        9.26246       -1.86930
  C       -3.49098       -6.90590       -3.83405
  C        3.49692        0.70216       -3.90258
  C       27.58924       -7.98655       -2.61848
  F      -42.65572       -4.10901       -1.01417
  C      -21.03362       -9.69786       -3.07340
  C       -8.70129      -17.36094       -3.32463
  F       -2.03012      -17.46699       -3.42751
  C        3.65269       17.86144       -3.38725
  S       39.06843        1.84321       -1.49212
  C        7.04222       17.12505       -3.36915
  F       17.78012        0.08694       -3.40954
  C      -21.75418       -3.72267       -3.13350
  H      -27.89076        9.97748       -2.51309
  C       -8.78314        7.61565       -3.66874
  H      -21.40718       -8.84669       -3.03443
  C      -27.53019        9.12021       -2.54557
  C       34.78689        8.94754       -1.83001
  C        7.88973       -0.92245       -3.76866
  F      -30.47652        5.10854       -2.35661
  C        8.20900        0.39318       -3.75736
  N      -10.24058        1.61503       -3.69389
  C       20.59968       -4.33173       -3.15142
  C        6.72296       15.80942       -3.38044
  C      -22.92095       13.00921       -2.74529
  C      -26.47954        6.61738       -2.66446
  C      -10.57301        0.29902       -3.65569
  H      -26.10599        5.76621       -2.70343
  N       11.16861        5.83528       -3.56733
  C        4.81946        1.12956       -3.77546
  H      -20.84997       -3.50726       -3.10208
  C      -13.64471        4.38893       -3.48035
  C       27.09052       -6.72882       -2.57007
  C        9.83685        6.02890       -3.58917
  F       20.28466        0.90486       -3.14812
  C       43.58347      -13.10058       -0.51256
  H       20.23911       -3.47446       -3.11894
  H       34.24587        1.82310       -1.92396
  C       42.29356      -13.54389       -0.65334
  H       36.48542       -7.36502       -1.58150
  C       -8.00838      -14.73377       -3.32450
  H      -26.66319        0.42678       -2.63578
  H      -22.01675       13.22461       -2.71387
  H       14.65401       -5.08638       -3.35902
  C      -32.24061       -1.83369       -2.08932
  H       20.85711        9.04615       -2.92107
  C       33.42030        9.15855       -1.83576
  C       -7.41369        7.37043       -3.55722
  N      -12.31294        4.19531       -3.45851
  N        1.22110        6.43728       -3.65544
  C       13.72857       -4.99727       -3.38338
  H       24.69228        4.85944       -2.71996
  H       -7.77032      -13.83420       -3.31621
  H      -37.36555       13.63507       -1.20929
  C      -37.02435        4.23864       -1.50930
  C       20.48356        9.89732       -2.88210
  C      -31.92135       -0.51806       -2.07802
  H      -13.33776       -6.18915       -3.34445
  H      -36.19878       -3.09681       -1.59750
  C       23.79473        4.62421       -2.74712
  C       30.54785       10.95566       -2.00736
  I      -47.78138        2.64798       -0.04058
  C       19.27880      -16.02201       -2.67707
  C       29.17841       11.20088       -2.11888
  C       11.06538       -4.65863       -3.43411
  C      -42.12104        5.91554       -0.79224
  C      -25.75899        0.64218       -2.60435
  C        0.70946        7.69128       -3.55761
  F       15.05873       -7.86962       -3.19391
  H       10.14380       -4.54918       -3.45327
  C       -4.15904        8.56825       -3.49425
  C       -4.65775        9.82598       -3.44584
  F      -18.20341        8.54286       -2.99304
  C      -12.41617       -6.29860       -3.32529
  F        6.44491       -6.54905       -3.49007
  S      -30.20945      -19.80858       -1.55387
  C       20.60134      -15.59461       -2.54995
  C       -1.76462        3.21113       -3.58111
  C       19.43291       12.40015       -2.76321
  F      -14.44202       -8.66280       -3.14980
  F      -22.00150       16.02647       -2.41917
  H       19.07234       13.25742       -2.73073
  N       -0.47252        3.58639       -3.54608
  F       17.65335       -8.34340       -2.96246
  H        3.85915      -11.41799       -3.33359
  C       21.20411        3.92212       -2.82199
  H      -22.57395        7.88518       -2.64621
  C      -21.14975        4.53119       -2.80408
  C      -22.20039        7.03401       -2.68518
  C      -35.65776        4.02763       -1.50356
  H      -20.78917        3.67392       -2.83655
  H       20.29991        3.70672       -2.85342
  H      -14.03730      -11.44604       -2.98469
  C        3.49857      -10.56072       -3.30111
  C       -9.75298       -6.63724       -3.27456
  F      -20.83473       -0.70540       -2.80738
  H       28.33876       -8.21340       -2.11689
  C       24.52138      -13.02823       -2.26646
  H       -2.01487      -14.66513       -3.13281
  H       13.95446      -10.34327       -2.99926
  H       13.48724       11.64549       -2.97081
  F        9.03953       -7.02283       -3.25862
  H      -14.50453       10.54272       -2.95624
  C       15.88926      -15.28563       -2.69517
  C       12.56180       11.73461       -2.99517
  C       26.42247        8.74532       -2.23027
  C       13.03288      -10.23382       -3.01842
  C       24.69610       -1.37170       -2.48321
  H       -8.82754       -6.72635       -3.25020
  H      -33.36155       -7.04042       -1.60493
  C      -13.11187      -11.53515       -2.96033
  C       -1.11067      -14.44972       -3.10138
  C        9.89861       12.07324       -3.04590
  H        8.97702       12.18269       -3.06506
  C       23.19726      -13.42627       -2.28633
  C       16.20853      -13.97000       -2.68387
  H       14.54446        4.53765       -3.03682
  C      -23.76584      -16.70621       -2.06869
  C       25.92375       10.00305       -2.18186
  C      -13.58294       10.43327       -2.93708
  C      -28.85108       -2.57007       -2.07122
  C       10.36969       -9.89518       -3.06914
  C       14.30640        3.63807       -3.04510
  N       23.40401       -1.74697       -2.51824
  C      -24.74107       -9.13180       -2.28906
  H        9.44425       -9.80607       -3.09351
  C      -23.16837        1.34427       -2.52948
  H       -1.76080       -3.02001       -3.34435
  F       -5.70143       -1.55303       -3.30072
  C       23.52933       15.36018       -2.09499
  H       -1.45767       -9.32570       -3.20046
  C       22.22203       -5.85186       -2.50670
  F       -8.42282       -9.50959       -3.08509
  C       13.61349        1.01091       -3.04524
  C       -0.86325       -2.78479       -3.31720
  H       13.36174        0.11527       -3.04680
  C        1.47995      -13.74764       -3.02651
  H      -15.07858       16.81607       -2.52049
  C      -28.57831      -19.10519       -1.44620
  F      -40.12377       -3.33307       -0.74614
  F        5.27814       10.18283       -3.10186
  H      -15.09453       -4.33820       -2.91868
  H       35.31865        9.36686       -1.19329
  C      -10.44867      -11.87379       -2.90960
  N      -25.25272       -7.87780       -2.19124
  H        2.37750      -13.51241       -2.99935
  C        2.44793       -8.05789       -3.18221
  C      -15.33032       15.92042       -2.52205
  H      -22.27082        1.57950       -2.50232
  C       -1.83122       -8.47453       -3.16149
  H        8.40297       18.45604       -2.62931
  C      -14.85646       -3.43862       -2.91039
  N       22.23723       14.98491       -2.13003
  H       -2.92757       13.71186       -2.95614
  C      -22.44172      -16.30817       -2.04882
  H       -9.52709      -11.98324       -2.89044
  C        1.72737       -2.08270       -3.24232
  H      -34.52832        9.69145       -1.21672
  F      -15.60879        8.06908       -2.76159
  C       -2.03002       13.94709       -2.92899
  C      -10.91975       10.09464       -2.88635
  F       13.89196        8.86225       -2.80570
  H        2.07437       -7.20672       -3.14324
  C      -14.16355       -0.81145       -2.91026
  H        2.63157       -1.86729       -3.21090
  C        8.15123       17.56039       -2.63087
  N      -23.55910       -5.02691       -2.30060
  H      -13.91181        0.08419       -2.90870
  F      -19.49695       16.84440       -2.15775
  C      -16.02323       13.29326       -2.52218
  C      -19.37386      -11.26649       -2.40084
  C        0.56060       14.64918       -2.85411
  H      -16.26130       12.39368       -2.53046
  N       21.71039       -4.59786       -2.40888
  H       -9.99431       10.00552       -2.86199
  H        1.46480       14.86458       -2.82269
  H        9.56974        1.72416       -3.01752
 Co       34.22231       -1.15701       -1.30402
  C        9.31800        0.82852       -3.01908
  C      -27.52853       -2.14267       -1.94410
  H        8.38702       -2.69823       -3.02750
  C        8.62509       -1.79865       -3.01921
  I       35.80991      -11.77270       -0.88922
  C      -19.87258      -10.00876       -2.35243
  C       -7.59229      -16.92560       -2.58635
  F        7.87276        9.70905       -2.87041
  F       16.48657        8.38848       -2.57425
 Co      -36.22234       -6.07692       -0.97756
  C       41.74681       -5.17896       -0.30589
  C       -2.88187       -5.97170       -3.04260
  H      -31.20892       -0.21283       -1.56409
  H      -10.11981       -1.52470       -2.93798
  N      -24.72586       11.70497       -1.91239
  C       -9.86806       -0.62906       -2.93642
  C       -4.20276      -17.66198       -2.56825
  C      -22.26700       -4.65164       -2.26557
  F      -18.33018        0.11252       -2.54596
  C       -9.17515        1.99810       -2.93628
  C        7.45832       14.93323       -2.63100
  C      -39.36249        5.41967       -0.56588
  H       -3.24244       -5.11443       -3.01012
  H       -8.93709        2.89768       -2.92800
  F       -5.82820       -9.98337       -2.85364
  C       40.40743       -4.91284       -0.43021
  F       -3.19689       -0.73511       -3.03930
  C      -25.90784        7.60008       -1.90085
  I       39.31361       -9.00291       -0.46604
  C       -7.27302      -15.60997       -2.57505
  H        7.22025       14.03365       -2.63928
  N      -26.41949        8.85408       -1.80303
  F        1.48005       17.66644       -2.52799
  H       27.17199        8.51848       -1.72868
  C       21.05526       10.88002       -2.11849
  H      -15.20407        5.28584       -2.59647
  H        2.69238        5.31389       -2.94537
  C       42.41669        3.63130       -0.12435
  C       32.24893       -6.39230       -1.28055
 Co      -37.38911       10.65496       -0.58935
  C        2.33180        6.17116       -2.91289
  C      -23.43377       12.08023       -1.87735
  C       41.12679        3.18798       -0.26513
  C       29.49037       -5.89643       -1.50691
  C      -14.27864        5.19672       -2.57211
  H       12.78769        6.38861       -2.61105
  H       25.10821      -13.39866       -1.64806
  F        2.64683        0.93457       -2.91620
  H       22.99701       -6.05104       -2.03322
  F       -9.58959        7.22228       -2.69688
  C       -2.88021      -17.23458       -2.44113
  N       20.54361       12.13402       -2.02067
  C       11.86611        6.49806       -2.63020
  H       16.92095      -13.66477       -2.16994
  C        1.28116        8.67398       -2.79400
  H       -2.62444        7.40618       -2.81225
  H        0.90760        9.52515       -2.75503
  C       -2.99799        8.25735       -2.77328
  H        8.27748        6.92581       -2.70529
  C        9.20291        6.83669       -2.68093
  S       33.96507       -6.52541       -0.97098
  H       -4.40921       11.61745       -2.62191
  H       25.25972       -1.75588       -1.84949
  C       -4.04864       10.76018       -2.65439
  H      -23.96609       -9.33098       -1.81558
  S       27.77710       -5.42189       -1.58725
  H      -35.12600        4.44695       -0.86683
  C      -16.61792       -8.81094       -2.28945
  F        3.98460       18.48437       -2.26657
  F      -30.49911       -9.25227       -1.20694
  C       18.11202        0.70987       -2.28886
  I      -43.92599        0.37444        0.26558
  C      -25.91449      -18.24243       -1.18832
  C       13.09464       -4.18947       -2.47515
  C      -11.61545        4.85809       -2.52138
  C      -43.44204       13.21027        0.50433
  H       -3.18164        2.06675       -2.74460
  C       23.35461        3.70365       -1.87825
  C       19.43457        1.13727       -2.16174
  C      -42.27527       -3.52161        0.11611
  N       11.76287       -3.99586       -2.49698
  S      -31.37622       -3.07670       -1.16566
  C      -21.03935        6.72311       -1.96422
  H       24.09295       14.97600       -1.46128
  C       -2.27744        2.28215       -2.71317
 Cl        6.03918        5.05379       -2.62980
  C      -20.54063        5.46538       -2.01263
  H      -10.69386        4.74864       -2.50223
  F        5.15137        1.75249       -2.65478
  C       22.03049        3.30561       -1.89812
  C        4.10769       -9.62652       -2.50966
  C      -15.24848       -9.05616       -2.17794
  C       15.04176        2.76188       -2.29566
  C      -24.93262        0.02567       -1.68048
 Cl       -5.65772        3.60468       -2.58998
  F       41.43196      -13.28912        0.34969
  H      -18.62434      -11.49334       -1.89926
  N      -11.71868       -5.63583       -2.38816
  C       14.72249        1.44625       -2.30696
  C        0.31318        2.98424       -2.63830
  S       16.75365      -16.52864       -1.77151
  H        1.21073        3.21947       -2.61114
  H      -21.85489      -16.67860       -1.43042
  F       -6.99498        6.74851       -2.46543
  C       18.38479      -15.82525       -1.66384
  C       31.08216       10.33958       -0.89234
  C        3.60897       -8.36879       -2.46125
  C      -10.38691       -5.82944       -2.36633
  H       21.83024       10.68083       -1.64501
  C       28.32360       10.83545       -1.11870
  F       27.78892        0.81090       -1.34063
  F       29.15411       18.31872       -0.68438
  F       26.62215       17.54277       -0.95242
  C       11.92787       12.54240       -2.08694
  C        6.86363       -7.17097       -2.39827
  S      -37.64635        5.28655       -0.25631
  C      -23.60849        0.42371       -1.66061
  N       10.59610       12.73602       -2.10877
  C       -0.28429      -15.06624       -2.17751
  F       30.32088        1.58684       -1.07260
  S       26.61033       11.30998       -1.19903
  H      -25.13286        7.40089       -1.42737
  C      -17.78470        7.92094       -1.90124
  H       -6.56060      -15.30474       -2.06112
  C        1.03983      -14.66820       -2.15764
  F      -31.66588        7.47961       -0.81873
  C      -41.60538        5.28865        0.29765
  C      -14.62538       14.99234       -1.80277
  C       12.47211       -9.42430       -2.10941
  C       -1.25952       -7.49183       -2.39788
  I       38.14684        7.72896       -0.07782
  C      -13.45861       -1.73953       -2.19098
  C        8.23307       -7.41619       -2.28676
  C      -42.15214       13.65358        0.64511
  C        8.85617       16.63231       -1.91159
  C      -29.74509       -2.37331       -1.05799
  N      -13.79103       -3.05555       -2.15279
  C       21.04861      -14.96249       -1.40596
  C       10.02295       -0.09956       -2.29980
  N      -12.88545       11.09605       -1.99995
  S       32.79830       10.20646       -0.58277
  I       34.64314        4.95918       -0.50100
  C       11.10552       -9.21330       -2.11515
  C      -12.37603      -10.85327       -2.00633
  S      -44.90403       -3.65512        0.79743
  C      -40.98537       -3.07830        0.25690
  N       -0.07754       -3.38694       -2.40942
  H      -21.70338       -5.03582       -1.63185
  N      -14.95781       13.67633       -1.76458
  N        9.69052       -1.41558       -2.26161
  C        1.21455       -3.01167       -2.37439
  C      -11.00944      -11.06427       -2.00059
  C      -11.55368       10.90243       -1.97812
  N       -1.77117       -6.23783       -2.30006
  N        8.52374       15.31630       -1.87340
  F      -27.88315       -9.68102       -0.96686
  C       -8.75906       -0.19372       -2.19814
  I      -38.00541       -7.61927        0.06959
  C      -16.41525        7.67571       -1.78973
  S      -24.23243      -17.88698       -0.86742
  N       -1.24432       13.34494       -2.02121
  C       -8.43979        1.12191       -2.18684
  H      -22.87015       11.69605       -1.24364
  C        0.04778       13.72021       -1.98617
  S       43.97575       -6.28038        0.86434
  S       -6.72790      -18.16861       -1.66269
  S       22.73067      -14.60704       -1.08506
  C       -5.36953       -0.93010       -2.18004
  C        2.94092        7.10535       -2.12145
  I      -35.80151        0.03927       -0.17454
  C        5.69686        9.56091       -2.01006
  H        4.85721       -9.85337       -2.00807
  C      -40.26601        5.02253        0.42198
  C        2.44220        8.36308       -2.07304
  H       15.75418        3.06711       -1.78173
  H       23.94144        3.33322       -1.25985
  H      -19.79111        5.23854       -1.51104
  C       -2.42629        9.24005       -2.00967
  H       13.60155       -3.76048       -1.82257
  C      -28.15109      -18.46380       -0.32689
  C        7.06630        9.31569       -1.89855
  I      -39.17219        9.11260        0.45780
  C       42.26247       -5.80585        0.78400
  N       -2.93794       10.49405       -1.91185
 Co       22.56227       -3.13484       -1.27648
  C       -5.09676      -17.46522       -1.55502
  C       -4.04699       -0.50270       -2.05292
  S      -19.18600       -8.70183       -1.36961
 Co      -24.40083       -6.41478       -1.05884
  S       37.78778       -5.17686        0.24808
  H        9.59755       16.91501       -1.42693
  H       -0.48454       -7.69101       -1.92440
  C       11.30534        7.30757       -1.72119
  H       10.76432        0.18313       -1.81514
  F      -29.04992        7.05086       -0.57864
  H      -13.88400       15.27504       -1.31811
 Co      -45.90240        1.60455        1.37706
  C        9.93875        7.51858       -1.72694
  C       39.50391       -5.30998        0.55765
  C      -27.08126       -1.51055       -0.80011
  H      -12.71723       -1.45684       -1.70632
  C      -13.54280        5.87861       -1.61812
  H       12.43478       12.97139       -1.43436
  I       32.43924       -2.69936       -0.25687
  F       42.79715        4.21870        1.00594
  C       31.34542       -6.78944       -0.29270
  C       30.00604       -6.52332       -0.41702
  H       -9.88000       -5.40045       -1.71375
  F       16.46399       -5.97233       -1.42458
 Co       21.39550       13.59704       -0.88827
  C      -17.47273       -9.17637       -1.28927
  H        1.62666      -15.03863       -1.53924
  C      -12.17621        5.66760       -1.61238
  H        7.65507        3.81615       -1.78154
  I       35.94293        0.07042        0.16631
  H      -23.02166        0.05328       -1.04221
 Co      -25.56760       10.31710       -0.67063
  I       27.68543      -11.43752       -0.44909
  C      -43.22196       -3.29967        1.11834
  H       13.00387       -9.00499       -1.47268
  F       40.26519        3.44276        0.73790
  C      -26.86118      -18.02049       -0.18610
 Co       37.53054      -10.54527        0.58112
  H       45.32635        6.78548        1.51480
  F       19.07995       -6.40108       -1.18450
  C       -1.45106        1.66564       -1.78930
  I       23.83004       -9.16399       -0.75525
  C       -0.12694        2.06368       -1.76943
  H       -7.72738        1.42714       -1.67291
  S       15.58688        0.20324       -1.38330
  H        1.77817       -3.39585       -1.74067
  H       -4.22642        5.01403       -1.68031
  C       17.21802        0.90663       -1.27563
  C       -2.43295      -16.60246       -1.29714
  S      -20.35278        8.03004       -0.98139
  H      -11.04677       11.33142       -1.32554
  H      -10.47768      -10.64496       -1.36386
  H        3.69044        6.87851       -1.61986
  F      -19.17418       -2.46904       -1.12299
  F      -20.34095       14.26283       -0.73478
  C      -30.03722       -9.83275       -0.10375
  H       -1.65131        9.04086       -1.53619
  C       19.88183        1.76939       -1.01775
  H        0.61140       13.33603       -1.35246
  I      -23.13305      -12.44393       -0.53761
  H       43.41408       -3.48888        1.39399
  F      -42.42007        4.87080        1.28508
  F       15.29722       10.75955       -1.03637
  S        4.29555       -7.06186       -1.47843
  C      -14.71417       -9.67224       -1.06291
  C        6.00882       -7.53640       -1.39809
  C      -18.63950        7.55551       -0.90106
  C       28.83927       10.20856       -0.02881
  C        6.82924        4.16552       -1.41301
  C       30.17864        9.94244        0.09552
  S      -25.39920       -1.15510       -0.47921
  C       27.00260       18.13018        0.17787
  C       28.29251       18.57349        0.31865
  F       -7.01756       -7.61230       -1.31576
  F       17.91318       10.33080       -0.79628
  C       28.16937        1.39830       -0.21034
  C       18.81201      -15.18386       -0.54453
  C       29.45928        1.84161       -0.06956
  C      -28.69785      -10.09887        0.02057
  N       47.18207        6.77657        2.18355
  S       21.56390        2.12484       -0.69685
  I      -34.50172       -4.84949        0.49277
  I      -32.29781        2.80905        0.24863
  C       -4.99461        4.53684       -1.33096
  H       11.83710        7.72689       -1.08447
  S       -0.75088      -16.24701       -0.97624
  C        8.76738       -8.03227       -1.17173
  C       20.10192      -14.74055       -0.40374
 Co       10.74076       -2.79698       -1.19520
  S       -7.89467       -1.43673       -1.27448
  C       44.66232       -4.97345        1.84716
 Co      -12.74079       -4.43695       -1.08638
  I      -35.66850       11.88239        0.88098
  C      -31.20399        6.89913        0.28446
  C      -41.72491       14.29497        1.76443
  H       37.50697      -13.52538        1.20106
  F      -17.80899       15.03878       -0.46674
  H      -46.33714        4.52076        2.13381
  C      -45.37061       -4.83589        1.99871
  C      -29.31786       -1.73193        0.06133
  I       12.32836      -13.41267       -0.78040
  F      -16.64222       -1.69310       -0.85496
  S      -32.65688      -10.09677        0.57454
  C       45.88997        6.40130        2.14851
  I       22.66327        7.56789       -0.36704
  H        6.27090        3.40628       -1.18213
  F        4.30737       -0.82907       -1.23181
 Co        9.57398       13.93490       -0.80699
  F        3.14060       15.90280       -0.84360
  C      -40.55814       -2.43691        1.37621
  S        3.12878        9.67001       -1.09021
  H      -11.64445        6.08692       -0.97565
 Co      -13.90757       12.29493       -0.69817
  C       44.16360       -3.71572        1.89557
  C       -6.26353       -0.73334       -1.16681
  I      -11.15318      -15.05264       -0.67158
  I       26.51866        5.29435       -0.06088
  F       -4.40160       -8.04105       -1.07568
 Co       -0.91928       -4.77481       -1.16766
 Co       36.36377        6.18660        0.96933
  F      -29.01269      -18.20903        0.67615
  C        4.84205        9.19548       -1.00988
  S      -12.99803       -9.80536       -0.75335
  I      -19.27767      -14.71747       -0.23145
  F       -8.18433        9.11958       -0.92755
  H       -5.65212        5.19981       -1.06708
  H        0.45989        1.69325       -1.15103
  C      -15.88094        7.05964       -0.67470
  H       35.26742       -4.33726        0.85860
  S       10.48352       -8.16539       -0.86217
  I      -24.29982        4.28795       -0.14940
  I      -26.37724       -5.18466        0.05264
  C       46.79134        0.40539        2.41242
  C      -29.86462        6.63301        0.40878
  F        5.67256       16.67875       -0.57556
  S      -40.09378       14.99835        1.87209
  C      -28.02795       -1.28861        0.20211
  F        6.83933       -0.05313       -0.96378
  F      -39.80411        4.44205        1.52516
  C       41.40767       -6.17128        1.78419
 Co       -2.08605       11.95707       -0.77945
  C        7.60061        8.69961       -0.78352
  I      -27.54400       11.54721        0.44086
  N       38.58078      -11.92667        1.64752
  H       46.19692       -6.13552        2.52916
  C       40.03822       -5.92606        1.67267
  S      -38.92701       -1.73352        1.48388
  I       15.83206      -10.64288       -0.35722
  S      -33.82365        6.63510        0.96275
  C       38.24835      -13.24269        1.68572
  C       -3.59972        0.12942       -0.90893
  H      -35.17723       -9.25717        1.18506
  C       -4.66954      -16.82383       -0.43571
  F       31.80730       -7.36992        0.81049
  N      -46.74413        0.21669        2.61882
  F       29.19134       -6.94117        0.57041
  F       -5.56837        8.69083       -0.68746
  H       34.66974       -9.58176        1.20848
  C       16.92588       -6.55281       -0.32139
  I       20.58587       -1.90472       -0.16500
  I       24.44125       -4.17826        0.14117
  C       45.82336       -5.28436        2.56813
  I        0.34849      -10.80396       -0.64643
  C      -16.95706       -9.80326       -0.19938
  C      -30.94074      -10.22989        0.88411
  C       18.26525       -6.81893       -0.19707
  H       48.86532        6.40964        3.11848
  S      -14.16480        6.92652       -0.36513
  C      -43.94147       14.06432        2.65053
  N      -45.05051        3.06758        2.50947
  C      -45.56216        4.32158        2.60729
  C       -3.37963      -16.38052       -0.29492
  C       37.16577       -4.12895        1.50106
  S        9.31675        8.56649       -0.47395
  I       19.41909       14.82715        0.22322
  C      -42.77469       -2.66755        2.26232
  F      -26.48073      -17.43309        0.94418
  C       17.64524        1.54801       -0.15631
  C       47.96777        6.17441        3.09133
  I        4.20388      -13.07750       -0.34027
  H      -36.34400        7.47471        1.57327
  C      -15.61769      -10.06938       -0.07506
  I       11.16159        3.31921       -0.39218
  S       24.37385       17.99666        0.85919
  S       -1.91765        0.48487       -0.58803
  H      -39.09430       -4.59739        1.88231
  C       18.93515        1.99133       -0.01553
  C      -19.96050       14.85024        0.39551
  I       23.27448       12.55362        0.52938
  I       -7.64949      -12.28285       -0.24840
  C       35.79918       -3.91794        1.49532
  S       25.54062        1.26479        0.47097
 Co      -34.08088        1.26669        1.29579
  C      -18.79373       -1.88164        0.00730
  S       30.35087       19.91826        1.54564
 Co       25.70902      -10.20741        0.66239
  H      -40.26107       12.13448        2.27053
  I      -22.52185       -7.45820        0.35881
  H       36.34020        3.20650        1.58927
  C       44.77272       -2.78153        2.68702
  I      -12.31996        1.67924       -0.28336
  I      -20.44444        2.01441        0.15676
  C       15.75910       10.17907        0.06682
  F       44.45770        2.45506        2.69033
  C        6.52449       -8.16329       -0.30820
  C       48.86914        0.17850        3.35524
  C       28.71973       19.21488        1.43797
  C      -42.61892       14.49173        2.77765
  F       28.02457        9.79071        0.95862
  S       31.51764        3.18639        1.15742
  H       44.41215       -1.92426        2.71950
  C       26.05592       18.35212        1.18009
  C      -32.10751        6.50199        1.27232
  F       30.64053        9.36196        1.19870
  I      -14.52387       -5.97930       -0.03923
  C       17.09848        9.91295        0.19115
  C      -18.12383        6.92862        0.18883
  F       17.95041      -14.92909        0.45851
  C        7.86387       -8.42941       -0.18388
  C       27.22269        1.62024        0.79188
  F      -30.17946       -1.47715        1.06436
  C      -18.67059       15.29355        0.53629
  F       41.95316        1.63714        2.42891
  C       -6.55567       -8.19278       -0.21257
  N       36.50842       -9.34639        1.88290
  C       29.88650        2.48300        1.04975
  I       14.66529        6.08899        0.03099
  C      -41.45215       -2.24015        2.38944
  H       38.70155      -15.06641        2.40343
  C       38.95329      -14.17077        2.40499
  C      -17.50382       -1.43833        0.14808
  C      -28.18218      -10.72576        1.11046
  C       45.37715        5.47233        3.01645
  C       39.64621      -11.54360        2.40513
  I       -0.81828        5.92792       -0.25822
  H       39.88427      -10.64402        2.41341
  N       47.57704       -0.19677        3.32020
  I        8.95768       -4.33933       -0.14805
  I      -23.68863        9.27368        0.74702
  H       33.50297        7.15011        1.59670
  H      -36.94168        2.23020        1.92315
  F       20.48237      -14.15315        0.72654
  C       35.17665       -9.15278        1.86106
  C       -5.21630       -8.45890       -0.08825
  N       37.41400        4.80521        2.03574
  I      -15.69064       10.75257        0.34898
  H       44.47295        5.25692        2.98503
  C      -34.64547       -8.83786        1.82178
  C      -16.78446        6.66250        0.31316
  C       43.45183      -14.47181        3.16137
 Cl        7.17985        4.95442       -0.06660
  C        3.52105       16.49021        0.28669
  C       46.39507       -4.30166        3.33174
  C       37.08158        3.48919        2.07393
  C        4.68782       -0.24167       -0.10152
 Co      -21.25408      -13.48735        0.88003
  S      -26.46890      -11.20029        1.19080
  C       -5.83631       -0.09196       -0.04749
  I        7.79091       12.39254        0.24016
  I       -2.89568       -3.54469       -0.05618
  S      -22.58925       14.71672        1.07683
  C        5.35772        8.56859        0.08001
 Cl       -4.53362        3.74291       -0.02128
  C      -33.27888       -9.04886        1.82752
  C        4.81096       16.93352        0.42747
 Cl       -7.03843       -4.84473        0.05837
  S      -21.42248       -2.01515        0.68861
  S       14.30622       -6.81683        0.35690
 Cl        4.67504       -3.63322        0.01304
  C       -7.72245        8.53910        0.17564
  C        5.97773        0.20164        0.03926
  I       -8.81626        4.44902        0.13981
  H       31.35035        0.32252        1.55586
  F       41.82638       -6.79320        2.87598
  C      -38.38189       -4.29216        2.39625
  I        3.03710        3.65438        0.04794
 Co       24.54225        6.52447        1.05060
  C        6.69709        8.30247        0.20434
  I       12.46138       -1.56955        0.27513
  C      -39.22939       13.75535        2.79575
  I       -4.06246       13.18718        0.33204
  C      -39.54866       12.43971        2.78446
  N       45.88342       -3.04766        3.42956
  H       38.82705       -3.53618        2.47942
  H      -45.36401        6.15545        3.40987
  H      -34.10445       -1.71341        1.91573
  C      -35.81224        7.89402        2.20999
  C       -4.54640        0.35136        0.09329
  C      -29.34895        6.00612        1.49867
  C      -38.06261       -2.97653        2.40754
  C      -44.99046        5.30428        3.37090
  F       -5.53114      -16.56906        0.56733
  I       11.29461       15.16233        0.66334
  F      -27.64750       -0.70121        1.33239
  F       39.23176       -6.31942        2.64453
  F      -17.77176      -10.22111        0.78805
  C       -6.38307        8.27298        0.29997
  C       37.90161       -3.44707        2.45506
 Co       14.04899      -12.18524        0.68994
  C      -43.93981        2.80145        3.25201
  H      -43.57924        1.94418        3.21953
  I      -11.02017       -3.20952        0.38395
  H       23.01157      -11.58637        1.23541
  H       23.16308        0.05641        1.03397
  C       16.02236       -6.94995        0.66647
  H      -23.95153      -14.86631        1.45305
  N       35.34165        7.38548        2.27111
  F      -43.62479       -2.43514        3.24870
  I        0.95970       -5.81823        0.24999
  H       21.99631       16.78828        1.42219
  H       47.17004       -4.50084        3.80522
  S       20.49420       -7.92035        0.97316
  S       -9.17533       -8.45680        0.46572
  C      -34.44565        7.68302        2.21573
  C       18.78092       -7.44582        0.89282
  I      -12.18694       13.52236        0.77216
  C       40.06229      -13.73542        3.14327
  C       47.52764        5.25385        3.96020
  C       40.38156      -12.41979        3.15457
  F      -40.99347        6.81312        3.06305
  C       34.00988        7.57910        2.24927
  S      -27.63567        5.53158        1.57901
  S       13.13945        9.91504        0.74511
  H       25.27429       -7.29120        1.41914
  H      -23.80002       -3.22353        1.25161
  C      -30.40643      -10.84597        1.99913
  C      -20.90718       15.07218        1.39773
  H       38.71750        6.08785        2.80162
  H      -24.96679       13.50834        1.63983
 Co       -9.43256      -13.82521        0.79876
  C       38.47943        5.18828        2.79334
  C      -19.74041       -1.65970        1.00952
  H       38.12750       -8.79307        2.83918
  F       16.78364        1.80279        0.84672
  C       32.38203        1.94338        2.08108
  C       35.23842       -3.10843        2.40433
  F       -2.99918      -15.79312        0.83536
  C       32.06276        0.62775        2.06979
  C      -36.43477        2.65919        2.57573
  H      -27.03057       -8.40879        1.72045
 Co      -22.42085        3.24452        1.26824
  I       -0.20707       10.91365        0.63820
  C       46.20352        4.85581        3.94032
  F      -15.15579      -10.64986        1.02813
  C       37.20591       -8.68362        2.82003
  H       34.31683       -2.99898        2.38517
  C       37.78652        2.56111        2.79321
  F       19.31560        2.57873        1.11476
  F        5.70979       -8.58114        0.67923
  H      -36.12782       -7.91889        2.71163
  H       37.53478        1.66547        2.79165
  F      -27.32472      -20.01465        2.36715
  F      -18.93853        6.51077        1.17626
 Co        2.22747      -11.84738        0.77121
  S        0.89230       16.35669        0.96801
  N       26.56091       -8.74439        1.79480
  C       14.85559        9.78193        1.05468
  C      -31.49136      -19.09068        2.73145
  C      -29.03698      -11.09119        2.11065
  C       -7.45919       -8.58992        0.77529
  S        2.05907       -0.37518        0.57979
  S      -10.34210        8.27507        0.85393
  C       27.82573       19.41164        2.45120
  C       43.60760        2.68747        3.67671
  N      -35.10300        2.46557        2.59757
  C      -33.36307       -1.43072        2.40039
  N      -33.03065       -0.11470        2.36220
  C       26.50319       18.98423        2.32407
  H       14.02542      -15.16535        1.30988
  S       19.32742        8.81152        1.36137
  C      -35.20623       -8.02834        2.73079
  C       17.61415        9.28606        1.28103
  F      -42.28701       15.11466        3.89833
  C       25.07403        0.08402        1.67225
  C       42.28506        2.26007        3.54959
  F        8.32576       -9.00989        0.91931
  H       11.78587       -5.97723        0.96742
  C       23.90726       16.81589        2.06046
  N       24.86729      -11.59528        1.90415
  C       27.66996        2.25236        1.93586
  H      -21.68882      -10.57115        1.63678
  C       28.99250        2.67976        2.06298
  C       26.04926       -7.49039        1.89262
  C      -18.24337       15.93494        1.65561
  H       41.09398      -12.11456        3.66850
  H      -28.19734        8.32309        2.10866
  H       24.10752        9.44067        1.80735
  C      -31.57320        5.88591        2.38734
  H      -37.29459        8.81298        3.09984
  C       34.54272       -8.34498        2.76930
  C       23.74991       -0.31402        1.65238
  C       23.57519      -11.97055        1.86912
  F       33.21257       -5.47262        2.57982
  H      -11.69568       -7.61720        1.07624
  H      -37.88459       -6.06793        3.13740
 Co       12.88222        4.54663        1.07815
  F      -41.12025       -1.61722        3.51012
  C       22.58314       16.41785        2.04059
  C      -17.07660       -0.79694        1.26739
  F       30.61795       -4.99885        2.34837
  H       48.11448        4.88342        4.57860
  H       21.84480        5.14551        1.62362
  H       33.61728       -8.25587        2.74494
  H       -9.45613      -16.80532        1.41870
  H       19.93253       -5.12885        1.50281
  H      -25.11830        1.86557        1.84126
  C      -37.64653       -5.16836        3.14569
  C        2.57437       16.71215        1.28891
  C       -4.70063       -9.08579        1.00164
  C      -23.38791      -15.25049        2.08676
  F      -38.39885        6.33934        3.29450
  H      -37.86864       15.08633        3.53559
  C      -36.37300        8.70354        3.11900
  C      -38.12038       14.19069        3.53403
  S      -16.61223       16.63832        1.76327
  C        3.74114       -0.01973        0.90070
  F       -6.69791        0.16282        0.95554
  H      -39.05136       10.66394        3.52562
  C      -38.81330       11.56352        3.53390
  H       11.18819      -11.22173        1.31730
  H      -12.29336      -12.86171        1.42612
  S       -2.98735       -9.56032        1.08198
  F        4.54302        8.15074        1.06744
  F      -16.32257        6.08202        1.41634
  H       36.96073        7.93881        3.22740
  C       42.55782      -14.27504        4.17460
  C       -8.62596        8.14196        1.16350
  C      -36.95361       -2.54119        3.14582
  C      -25.78233       -9.89336        2.17362
  C      -43.82942        4.99338        4.09186
  H        5.79354       -5.09013        1.05885
  C      -32.54304       -8.36698        2.78152
  H       33.74278        3.27436        2.82092
  H      -36.70187       -1.64555        3.14738
  N      -22.09581      -14.87522        2.12179
  C      -30.20375        5.64069        2.49886
  C      -23.21319       -3.59396        1.87001
  H       10.61910       10.75465        1.35563
  S      -15.44546       -0.09355        1.37506
 Co      -10.59934        2.90666        1.18697
  C      -26.28104       -8.63563        2.22203
  C      -43.33070        3.73564        4.04345
  C        5.23818       17.57491        1.54679
  C       33.49104        2.37872        2.81936
  S       40.92669      -14.97843        4.06693
  C       36.03914        8.04826        3.20824
  C      -24.37996       13.13791        2.25823
  C       39.21479        4.31208        3.54278
 Co       46.73531       -1.58463        4.56196
  S        6.86932       18.27830        1.65446
  N       25.39414        7.98749        2.18301
  F      -24.82018      -19.19672        2.62857
  H       -0.46998      -13.22634        1.34423
  H      -12.86245        9.11468        1.46445
  F       19.63837      -16.73471        2.14951
  C       38.89552        2.99645        3.53149
  H      -31.61760       -8.45609        2.80588
  H       28.03219       -9.86779        2.50486
  C       14.76680      -14.88266        1.79454
  C        6.40495        0.84303        1.15857
  C       32.79812       -0.24845        2.81923
  N       15.09923      -13.56664        1.75634
  H       -6.12948       -3.29659        1.17390
  C      -21.88907       -3.19592        1.88989
  H       32.56006       -1.14802        2.81095
  H       18.76576       11.60303        1.89102
  N      -20.40219      -12.02433        2.01243
  F       32.04579       11.25925        2.96804
 Co        1.06070        4.88450        1.15942
  H      -37.99414        3.55610        3.45961
  C       37.26768       -2.63927        3.36329
  F       29.45118       11.73303        2.73659
  H      -22.85559        6.16073        2.02499
  F        7.15898        7.72199        1.30752
  C      -23.05584       13.53595        2.27810
  H       -0.31847       -1.58356        1.14279
  C       24.88249        9.24149        2.28083
  S        8.03609        1.54642        1.26624
  H       -1.48524       15.14831        1.53101
  C       21.18077       -6.61342        1.95598
  C       27.67161       -9.01052        2.53734
  F       -4.16595        0.93876        1.22357
  F      -31.21289      -11.23933        2.97099
  F       22.14292      -15.91678        2.41093
  C      -20.91384      -10.77033        2.11025
  C      -33.70981        8.36490        3.16973
  C       -5.86740        7.64609        1.38985
  C        5.13603       -4.42715        1.32273
  C       16.55667       -7.56603        1.78149
  C       33.37595        8.38690        3.15751
  C       13.68422       -5.76892        1.60988
  C      -37.06870        3.46699        3.48397
  N       35.93591       -2.44565        3.34146
  C       20.68206       -5.35569        2.00439
  C       17.92612       -7.81125        1.89301
  C      -27.44782        8.09624        2.61025
  C       -6.68782       -4.05583        1.40478
  C       12.31763       -5.55791        1.60414
  C      -26.94910        6.83851        2.56184
  H       32.45051        8.47601        3.13315
  C       -8.71475      -16.52262        1.90336
  N       23.70052        5.13660        2.29236
  H      -32.78438        8.27579        3.19409
  S       -4.15413        7.17155        1.47019
  H      -32.90987       -3.25444        3.11811
  H      -15.61276       -2.95742        1.77350
  N       -8.38232      -15.20661        1.86516
  H        1.79274       -8.93118        1.52796
  C      -32.65813       -2.35880        3.11967
  H      -16.77953       13.77445        2.16171
  C       22.40842        4.76133        2.25733
  C      -30.38235      -18.65533        3.46973
  H       12.85865        1.56653        1.69809
  C      -11.16392       -7.19789        1.71296
  F      -28.49150       -3.28277        2.75537
  C      -40.57476        6.19120        4.15484
  C       26.62097       -6.50769        2.65623
  H       39.92721        4.61731        4.05671
  C       36.64515       -7.87410        3.72904
  C      -20.45992       15.70429        2.54171
  H       26.80461       -0.31709        2.62754
  C       -9.79733       -7.40889        1.71870
  H       26.55054      -11.96220        2.83909
  C      -31.96522        0.26837        3.11980
  H       10.02142        5.51014        1.70552
  H      -13.46013        3.87017        1.81434
  H      -24.80493      -16.39487        2.92327
  C      -24.55468        1.48139        2.47497
  H      -31.72715        1.16794        3.12808
  C       25.65299      -12.19743        2.81193
  H       -3.54902       -6.76882        1.61163
  C       25.90041       -0.53249        2.59612
  N       13.02687      -10.98636        1.99172
  H       25.63784       16.41479        3.01576
  C       20.01400       10.11845        2.34420
  H       26.24741       -5.65652        2.69520
  C      -30.06309      -17.33970        3.48103
  C       12.51745       10.96296        1.99810
  C      -19.29314       -1.02758        2.15350
  H        7.86880       -1.31745        1.66468
  C       11.69510      -10.79275        1.96988
  C       19.51528       11.37618        2.39261
  C       24.73364       16.19938        2.98433
  C       11.15086       11.17396        1.99235
  H        6.70202       15.41442        2.05289
  H        4.36784       -4.90434        1.67208
  H      -42.58118        3.50880        4.54504
  C      -11.78645      -12.43272        2.07870
  C      -34.40551        3.12835        3.53470
  C       23.06237      -12.89952        2.73706
  C      -23.90073      -16.17946        2.95470
  N      -21.56896        4.70755        2.40065
  F      -32.37966        5.49255        3.35920
  H      -10.62290       -0.07344        1.80691
  C       35.27855       -7.66310        3.72329
  N      -23.26259        1.85666        2.51000
  H       22.15817      -13.11493        2.70563
  C       23.30979       -1.23458        2.52124
  F       28.15763       20.03457        3.57187
  C       34.19598        1.45064        3.53864
  C       15.38990        9.16585        2.16970
  H       26.86541        6.86409        2.89307
  C      -22.08061        5.96155        2.49847
  F       25.65309       19.21665        3.31045
  H       -7.51365       -3.70646        1.77331
  C      -19.13737       16.13170        2.66883
  N      -34.50874       -7.36556        3.66792
  F      -28.61827      -11.71311        3.20244
  N      -10.45468      -12.62633        2.10054
  C       44.05487        3.31959        4.82069
  C       -6.92488       -9.20600        1.89031
  C        0.09364      -13.61052        1.97794
  H       22.41224       -1.46981        2.49409
  H       15.22000      -16.70638        2.51225
  F       -3.84318      -18.37468        2.25833
  C       26.50484        7.72136        2.92555
  C       16.75934        8.92063        2.28122
  H      -24.55086       -4.74975        2.71173
  H       -1.63675        3.50554        1.73244
  C      -12.33069        9.53399        2.10117
  H       37.77459       -2.21028        4.01587
  C      -26.99282      -19.39172        3.48783
  H       22.71537       -7.77549        2.63798
  N      -36.58110       -4.78529        3.90329
  H      -24.24773      -11.05543        2.85562
  N        3.07936      -10.38436        1.90361
  C      -37.41544       13.26260        4.25331
  C       15.47174      -15.81074        2.51381
  N        1.38574      -13.23525        2.01297
  C      -36.24867       -3.46927        3.86510
  N       33.86355        0.13462        3.57683
  C      -39.20531        5.94598        4.26636
  C       22.14302       15.49729        2.90946
  H      -33.48392        3.01890        3.55386
  S       45.73694        3.67504        5.14160
  C      -24.62128      -10.20427        2.89459
  C        0.26836       -1.95399        1.76119
  F       26.81986        2.48477        2.92224
  C      -17.97060       -0.60018        2.28062
  N      -37.74787       11.94659        4.29150
  C        1.59248       -1.55595        1.78107
  C      -10.96410        9.32299        2.10691
  H       21.24547       15.26206        2.88230
  F       29.32440        3.30269        3.18366
  C       41.39105        2.45683        4.56281
  C       -0.89841       14.77788        2.14941
  C       22.34181       -6.92433        2.67695
  C        0.42571       15.17592        2.16928
  H       -4.71579        9.96306        1.99984
  H      -25.71763       11.98212        3.09994
  C       32.40611       -5.86599        3.55169
  C      -23.65331       -4.51452        2.73888
  C       -5.55543       -9.45122        2.00183
  C       16.16466      -13.18357        2.51395
  N       13.93245        3.16524        2.14456
  H        0.62596        7.80070        1.91617
  C      -33.17697       -7.55918        3.68975
  C       25.45419       10.22419        3.04444
  C       31.03666       -5.62077        3.44017
  H       16.40272      -12.28399        2.52223
  C        2.56771       -9.13036        2.00144
  C      -25.67193       -7.70144        3.01348
  N      -35.67551        9.36631        4.05613
  H      -18.93092      -13.14773        2.72250
  H       25.08064       11.07536        3.08341
  C       13.60003        1.84922        2.18275
  H      -26.03251       -6.84417        3.04596
  C      -24.82008       12.21735        3.12709
  S       39.75992        1.75344        4.45515
  C      -15.74784       15.39532        2.68693
  C      -19.29149      -12.29046        2.75497
  C      -21.31011      -15.47737        3.02957
  C      -14.90033       -2.65219        2.28743
  F      -25.98695       -2.46485        3.01679
  C        3.02163       17.34426        2.43289
  C       28.28072       -8.07632        3.32878
  C      -16.06711       14.07968        2.67564
  C       -2.30078       -8.25340        2.06480
  C      -14.58107       -1.33656        2.29872
  C       35.47837        8.85778        4.11725
  H       -8.26155      -18.34635        2.62107
  C      -25.67028      -18.96432        3.61495
  F       18.47160       -0.00283        2.53773
  S      -43.14284        6.30030        5.07469
  C       42.98505      -13.63366        5.29392
  H      -20.41256      -15.24214        3.05673
  C        7.73371       17.03529        2.57812
  C        4.18841        0.61239        2.04468
  F       -1.33863      -17.55675        2.51975
  C       -2.79949       -6.99566        2.11321
  C        4.34418       17.77167        2.56001
  F      -16.34515       -8.27879        2.56601
  C       -8.00981      -17.45071        2.62263
  C       21.29117       -4.42150        2.79584
  C      -34.34374        9.17270        4.07797
  H       37.17691       -7.45479        4.36576
  H       34.93736        1.73333        4.02330
  C      -20.34214       -9.78763        2.87387
  C        8.58121       -1.01222        2.17861
  C       27.78201       -6.81859        3.37719
  C        8.90048        0.30341        2.18990
  C      -21.06269       -3.81244        2.81376
  C        7.41444       15.71965        2.56682
  C       -8.09165        7.52588        2.27852
  H      -27.19928        9.88771        3.43417
  F       20.97614        0.81509        2.79915
  H      -20.71569       -8.93646        2.91284
  N       11.86010        5.74551        2.37993
  N       -9.54910        1.52527        2.25338
  H       20.93060       -3.56423        2.82832
  C       34.11178        9.06878        4.11151
  C      -26.83870        9.03044        3.40169
  C        5.51095        1.03979        2.17180
  F      -29.78504        5.01877        3.59065
  C       10.52833        5.93913        2.35809
  C       -9.88153        0.20925        2.29157
  C      -22.22946       12.91944        3.20197
  C      -25.78806        6.52761        3.28280
  I       48.61428       -2.62806        5.97961
  H       21.54860        8.95638        3.02619
  H      -25.41450        5.67644        3.24383
  H       25.38377        4.76967        3.22730
  H       15.34549       -5.17615        2.58824
  C      -12.95322        4.29916        2.46691
  H      -20.15849       -3.59703        2.84518
  C       31.23934       10.86589        3.93990
  C       -7.31690      -14.82354        2.62277
  C       14.42006       -5.08704        2.56388
  C       21.17504        9.80755        3.06516
  C       29.86989       11.11111        3.82838
  C       24.48622        4.53444        3.20015
  C       19.97028      -16.11178        3.27019
  N        1.91259        6.34752        2.29183
  H      -21.32526       13.13485        3.23340
  H      -25.97170        0.33701        3.31148
  C       -6.72221        7.28066        2.39004
  H       -7.07883      -13.92396        2.63105
  N      -11.62145        4.10554        2.48875
  C      -31.54913       -1.92346        3.85794
  F       15.75021       -7.95939        2.75335
  C       11.75687       -4.74840        2.51315
  H       10.83528       -4.63895        2.49399
  C       21.29283      -15.68437        3.39731
  H      -36.67406       13.54530        4.73797
  C      -36.33287        4.14887        4.43796
  H      -12.64627       -6.27892        2.60281
  C       20.12440       12.31038        3.18405
  C        1.40094        7.60152        2.38965
  C      -31.22986       -0.60783        3.86924
  H      -35.50729       -3.18658        4.34976
  F        7.13640       -6.63882        2.45719
  H       19.76382       13.16765        3.21653
  C       -3.46755        8.47848        2.45302
  C       -3.96627        9.73621        2.50143
  F       18.34483       -8.43317        2.98480
  C      -41.42956        5.82577        5.15503
  C       21.89560        3.83236        3.12527
  C      -25.06750        0.55242        3.34291
  C      -11.72468       -6.38837        2.62197
  F      -17.51192        8.45309        2.95423
  C       -1.07313        3.12136        2.36615
  S      -29.51796      -19.89834        4.39339
  H       29.03024       -8.30317        3.83037
  H       20.99140        3.61695        3.09384
  H        4.55063      -11.50776        2.61368
  F      -13.75053       -8.75256        2.79746
  C       25.21286      -13.11799        3.68080
  N        0.21897        3.49663        2.40118
  F      -21.31001       15.93671        3.52809
  C       27.11395        8.65555        3.71700
  C       25.38759       -1.46147        3.46406
  H       14.64595      -10.43303        2.94800
  C       16.58075      -15.37539        3.25209
  H      -21.88246        7.79541        3.30105
  C        4.19006      -10.65049        2.64616
  I       44.75890       -0.35452        5.67345
  C      -20.45826        4.44142        3.14319
  H       14.17872       11.55573        2.97645
  C      -21.50891        6.94425        3.26208
  H      -20.09769        3.58415        3.11071
  C      -34.96628        3.93787        4.44371
  C       23.88874      -13.51603        3.66093
  C       13.25329       11.64484        2.95209
  C       13.72436      -10.32359        2.92885
  F        9.73102       -7.11259        2.68864
  H       -1.32338      -14.75490        2.81445
  H      -13.34582      -11.53581        2.96258
  C       26.61523        9.91329        3.76541
  C       -9.06149       -6.72701        2.67270
  C       16.90001      -14.05976        3.26339
  F      -20.14324       -0.79517        3.13988
  N       24.09549       -1.83674        3.42902
  C       10.59009       11.98348        2.90136
  H        9.66851       12.09292        2.88221
  H       15.23595        4.44788        2.91044
  C       -0.41918      -14.53949        2.84588
 Cl        5.79914       -3.49499        2.58175
  H      -13.81304       10.45296        2.99102
  H       -8.13606       -6.81612        2.69706
  C       14.99788        3.54831        2.90216
  C       11.06117       -9.98495        2.87812
  C      -12.42038      -11.62492        2.98694
  H       36.01014        9.27709        4.75397
 Cl       -5.89776       -4.94410        2.62156
  H       10.13573       -9.89584        2.85376
  C       24.22082       15.27041        3.85227
  C       22.91351       -5.94163        3.44056
  H      -32.67006       -7.13019        4.34233
  C      -23.07436      -16.79597        3.87857
  C      -12.89146       10.34351        3.01018
  C       14.30497        0.92114        2.90203
  H       14.05323        0.02550        2.90047
  H       -1.06931       -3.10978        2.60291
  C      -28.15959       -2.65984        3.87605
  C      -24.04959       -9.22157        3.65820
  C      -22.47688        1.25450        3.41778
  F       -5.00995       -1.64280        2.64655
  H       -0.76618       -9.41546        2.74680
  C        2.17144      -13.83740        2.92075
  N       22.92872       14.89514        3.81724
  C       -0.17176       -2.87455        2.63006
  F       -7.73134       -9.59936        2.86217
  F        5.96962       10.09306        2.84541
  H        3.06899      -13.60217        2.94791
  H        9.09446       18.36627        3.31795
  C        3.13941       -8.14766        2.76505
  H      -14.38710       16.72630        3.42677
  C      -27.88683      -19.19495        4.50106
  C       -9.75719      -11.96356        3.03766
  H      -14.40304       -4.42796        3.02858
  C       -1.13974       -8.56430        2.78577
 Co       34.91379       -1.24677        4.64324
  F       14.58344        8.77249        3.14156
  C      -14.63884       15.83066        3.42521
  N      -24.56123       -7.96757        3.75602
  H       -2.23608       13.62209        2.99112
  C        2.41886       -2.17247        2.70494
  H      -21.57933        1.48973        3.44494
  C      -14.16498       -3.52839        3.03687
  N       22.40187       -4.68763        3.53838
  H       -8.83560      -12.07300        3.05682
  C        8.84271       17.47063        3.31640
  C      -21.75023      -16.39793        3.89844
  H        2.76586       -7.29649        2.80402
  C       -1.33853       13.85732        3.01828
  H        3.32306       -1.95706        2.73636
  F      -14.91731        7.97931        3.18568
  C      -10.22826       10.00487        3.06091
  H      -33.83683        9.60168        4.73054
  C      -13.47206       -0.90122        3.03700
  C        1.25209       14.55941        3.09315
  H       10.26123        1.63439        2.92974
  H      -13.22032       -0.00558        3.03856
  N      -22.86761       -5.11668        3.64666
  H        2.15629       14.77482        3.12458
  C      -15.33175       13.20349        3.42508
  C       10.00949        0.73875        2.92818
  F      -18.80547       16.75463        3.78951
  H        9.07851       -2.78799        2.91977
  C      -18.68238      -11.35626        3.54642
  H      -15.56981       12.30391        3.41680
  C        9.31657       -1.88842        2.92805
  F       17.17806        8.29871        3.37301
  H       -9.30283        9.91576        3.08527
  C       43.10818        3.54153        5.82291
  F        8.56424        9.61928        3.07686
  C       -6.90080      -17.01537        3.36091
  C      -26.83705       -2.23244        4.00317
  C      -19.18109      -10.09853        3.59483
  C       -2.19038       -6.06147        2.90466
  C       41.81828        3.09822        5.68213
  C       32.94042       -6.48207        4.66671
  C       -3.51127      -17.75175        3.37901
  H       27.86347        8.42871        4.21858
  C        8.14980       14.84346        3.31626
  H       -9.42832       -1.61447        3.00929
 Co      -35.53086       -6.16668        4.96970
  C       -9.17658       -0.71883        3.01085
  C       21.74674       10.79025        3.82877
  H      -30.51744       -0.30260        4.38317
  H       -2.55096       -5.20420        2.93714
  N      -24.03438       11.61520        4.03488
  F       -5.13672      -10.07314        3.09362
  C       -8.48367        1.90834        3.01098
  H        7.91174       13.94388        3.30798
  C      -21.57551       -4.74141        3.68170
  F       -2.50540       -0.82488        2.90797
  H       -8.24560        2.80791        3.01926
  F      -17.63870        0.02275        3.40130
  C       -6.58154      -15.69973        3.37221
  C       30.18186       -5.98620        4.44036
  F        2.17154       17.57668        3.41927
  C      -38.67101        5.32990        5.38138
  C      -25.21636        7.51031        4.04641
  H       25.79970      -13.48842        4.29920
  H        3.38386        5.22412        3.00189
  H       23.68849       -6.14081        3.91404
  N      -25.72801        8.76431        4.14423
  C        3.02329        6.08139        3.03437
  N       21.23510       12.04425        3.92659
  S       34.65656       -6.61518        4.97628
  H      -14.51259        5.19607        3.35079
  H       17.61243      -13.75453        3.77732
  H       13.47918        6.29884        3.33622
  C       12.55759        6.40829        3.31706
 Co      -36.69763       10.56519        5.35791
  S       28.46858       -5.51166        4.36002
  C      -22.74228       11.99047        4.06991
  H       25.95121       -1.84565        4.09777
  F        3.33831        0.84480        3.03106
  C       -2.18873      -17.32434        3.50613
  C        1.97264        8.58422        3.15326
  C        9.89440        6.74693        3.26633
  C      -13.58715        5.10696        3.37515
  H        8.96896        6.83604        3.24197
  F       -8.89811        7.13252        3.25038
  H       -1.93295        7.31641        3.13501
  H        1.59909        9.43539        3.19223
  C       -2.30651        8.16758        3.17398
  C       18.80351        0.62010        3.65841
  H       -3.71773       11.52768        3.32535
  C       -3.35715       10.67041        3.29287
  F        4.67608       18.39460        3.68069
  H      -23.27460       -9.42075        4.13168
  C       24.04609        3.61388        4.06901
  C      -15.92644       -8.90071        3.65781
  C       20.12605        1.04750        3.78553
  H      -34.43451        4.35718        5.08043
  C       13.78613       -4.27924        3.47211
  H       24.78444       14.88623        4.48598
  N       12.45436       -4.08562        3.45028
  H       -2.49015        1.97698        3.20266
  C      -25.22301      -18.33220        4.75894
  C      -10.92396        4.76832        3.42588
  C       22.72197        3.21584        4.04914
  C       -1.58595        2.19239        3.23409
  F        5.84285        1.66272        3.29248
  S       17.44514      -16.61840        4.17575
  C       15.73324        2.67211        3.65160
  C      -20.34787        6.63335        3.98304
  S      -30.68474       -3.16647        4.78160
  C        4.79917       -9.71629        3.43760
  H      -10.00237        4.65887        3.44504
  C      -19.84915        5.37562        3.93463
  C       31.77365       10.24981        5.05492
  C       15.41397        1.35648        3.64031
  C       29.01508       10.74568        4.82857
  C       19.07627      -15.91502        4.28342
  C      -14.55699       -9.14593        3.76932
  C        1.00467        2.89447        3.30897
  H       22.52172       10.59107        4.30225
  N      -11.02719       -5.72559        3.55910
  H      -17.93286      -11.58311        4.04801
  H        1.90222        3.12970        3.33612
  C      -24.24113       -0.06410        4.26678
  H      -21.16340      -16.76836        4.51684
  S       27.30181       11.22021        4.74823
  C        4.30046       -8.45856        3.48601
  F       -6.30349        6.65874        3.48183
  C       12.61935       12.45263        3.86033
  C        7.55511       -7.26074        3.54899
  C       -9.69542       -5.91921        3.58093
  N       11.28759       12.64625        3.83849
  S       33.48978       10.11669        5.36449
  C        0.40719      -15.15600        3.76975
  C       21.74009      -15.05226        4.54130
  C       13.16360       -9.51407        3.83786
  C        1.73131      -14.75796        3.78962
  S      -36.95487        5.19678        5.69095
  C      -22.91701        0.33394        4.28665
  C        8.92456       -7.50596        3.66050
  C        9.54766       16.54255        4.03567
  H       -5.86912      -15.39450        3.88614
  C       -0.56804       -7.58160        3.54938
  C       10.71443       -0.18933        3.64746
  C       11.79700       -9.30307        3.83211
  H      -24.44138        7.31113        4.51989
  C      -13.93389       14.90257        4.14449
  C      -17.09321        7.83117        4.04602
  C      -12.76712       -1.82930        3.75628
  C      -40.91390        5.19888        6.24491
  N      -13.09955       -3.14532        3.79447
  N       10.38200       -1.50535        3.68565
  N      -12.19396       11.00628        3.94731
  C      -29.05360       -2.46308        4.88927
  N        0.61394       -3.47671        3.53784
  C      -11.68455      -10.94304        3.94093
  C        1.90604       -3.10144        3.57288
  N      -14.26632       13.58656        4.18268
  H      -21.01190       -5.12559        4.31541
  N        9.21523       15.22653        4.07386
  C      -10.31796      -11.15404        3.94667
  N       -1.07968       -6.32760        3.64720
  C      -10.86220       10.81267        3.96915
  S       23.42216      -14.69680        4.86220
  N       -0.55283       13.25517        3.92606
  C       -8.06758       -0.28349        3.74913
  C        0.73927       13.63044        3.96109
  S      -23.54094      -17.97674        5.07984
  C       -7.74831        1.03214        3.76042
  I      -37.31393       -7.70904        6.01685
  C      -15.72376        7.58595        4.15754
  S       -6.03641      -18.25837        4.28457
  H       24.63293        3.24345        4.68741
  H      -22.17867       11.60629        4.70362
  H       16.44566        2.97734        4.16553
  C        3.63240        7.01558        3.82581
  C        6.38834        9.47114        3.93720
  H        5.54869       -9.94314        3.93919
  C       -4.67804       -1.01987        3.76723
  C        3.13368        8.27332        3.87422
  H       14.29304       -3.85025        4.12469
 Co       23.25376       -3.22460        4.67078
  C      -39.57452        4.93276        6.36924
  C       -1.73481        9.15028        3.93759
  H      -19.09963        5.14877        4.43622
  C        7.75779        9.22592        4.04872
  C      -27.45960      -18.55357        5.62038
  N       -2.24645       10.40428        4.03541
  F       43.48863        4.12893        6.95320
  C       -4.40528      -17.55499        4.39224
  I      -38.48070        9.02283        6.40507
  C       -3.35550       -0.59247        3.89435
  H       10.28903       16.82524        4.52033
  S      -18.49452       -8.79160        4.57766
  I       33.13072       -2.78913        5.69039
  C       11.99682        7.21781        4.22607
 Co      -23.70934       -6.50454        4.88842
  C       32.03690       -6.87921        5.65457
  H       11.45581        0.09336        4.13212
  H        0.20694       -7.78078        4.02286
  C       30.69753       -6.61309        5.53024
  I       36.63441       -0.01934        6.11357
  F       40.95667        3.35299        6.68516
  C       10.63023        7.42881        4.22033
  H       13.12626       12.88162        4.51291
 Co       22.08699       13.50727        5.05900
  H      -13.19251       15.18527        4.62915
  H      -12.02574       -1.54661        4.24094
  C      -12.85132        5.78884        4.32915
  C      -26.38978       -1.60032        5.14715
  H        2.31815      -15.12840        4.40802
  H       13.69536       -9.09476        4.47458
  H       -9.18851       -5.49022        4.23351
  C      -16.78124       -9.26614        4.65799
  C      -11.48472        5.57784        4.33489
  H      -22.33017       -0.03649        4.90505
 Co      -24.87611       10.22733        5.27664
  C      -26.16970      -18.11025        5.76116
  S       16.27837        0.11347        4.56397
  C       17.90950        0.81686        4.67163
  C       -0.75958        1.57587        4.15796
  C        0.56454        1.97391        4.17783
  H        2.46966       -3.48562        4.20659
  H       -7.03589        1.33737        4.27435
  C       -1.74146      -16.69223        4.65012
  H        4.38192        6.78874        4.32740
  S      -19.66129        7.94027        4.96587
  C       20.57332        1.67962        4.92951
  H       -9.78619      -10.73473        4.58340
  H      -10.35528       11.24166        4.62173
  H       -0.95983        8.95110        4.41107
  H        1.30288       13.24626        4.59480
  C       29.53075       10.11879        5.91846
  C       30.87013        9.85267        6.04278
  S        4.98703       -7.15163        4.46884
  F      -41.72859        4.78103        7.23234
  C        6.70031       -7.62617        4.54917
  C       19.50350      -15.27363        5.40274
  C      -14.02268       -9.76201        4.88435
  C      -17.94802        7.46574        5.04621
  S       22.25538        2.03507        5.25042
  S      -24.70771       -1.24487        5.46805
  C       20.79340      -14.83032        5.54352
  H       12.52859        7.63712        4.86279
  C        9.45887       -8.12204        4.77553
 Co       11.43224       -2.88674        4.75206
  S       -0.05939      -16.33677        4.97102
  I      -33.81024       -4.93925        6.44003
  S       -7.20318       -1.52650        4.67278
 Co      -12.04931       -4.52671        4.86088
  I      -34.97701       11.79262        6.82824
 Co       10.26547       13.84513        5.14027
  C      -28.62637       -1.82169        6.00859
  S        3.82026        9.58025        4.85705
  H      -10.95296        5.99715        4.97161
 Co      -13.21608       12.20516        5.24909
  C       -5.57205       -0.82311        4.78045
 Co       -0.22779       -4.86457        4.77960
  C        5.53354        9.10571        4.93739
  S       11.17500       -8.25515        5.08510
  F      -28.32121      -18.29880        6.62341
  S      -12.30655       -9.89512        5.19392
  H        1.15138        1.60348        4.79623
  C      -15.18946        6.96987        5.27256
  I      -25.68575       -5.27443        5.99991
  C        8.29210        8.60984        5.16374
  C      -27.33647       -1.37838        6.14937
 Co       -1.39457       11.86730        5.16782
  F       32.49879       -7.45969        6.75775
  F      -39.11263        4.35228        7.47243
  F       29.88283       -7.03094        6.51767
  I      -26.85252       11.45745        6.38812
  C       -3.97805      -16.91360        5.51156
  C       -2.90823        0.03965        5.03833
  I       25.13273       -4.26803        6.08843
  I       21.27735       -1.99449        5.78227
  C      -16.26558       -9.89303        5.74788
  I       20.11058       14.73739        6.17048
  S       10.00823        8.47672        5.47331
  C       -2.68815      -16.47029        5.65234
  S      -13.47332        6.83675        5.58213
  C       18.33673        1.45825        5.79095
  I       23.96596       12.46385        6.47664
  C       19.62663        1.90156        5.93173
  F      -25.78925      -17.52285        6.89144
  C      -14.92620      -10.15915        5.87221
  S       -1.22616        0.39510        5.35924
  F       31.33202        9.27219        7.14597
  F       28.71605        9.70094        6.90589
  I      -21.83037       -7.54797        6.30607
  C        7.21597       -8.25306        5.63906
  F       18.64190      -15.01886        6.40577
  C        8.55535       -8.51918        5.76339
  I      -13.83238       -6.06907        5.90803
  C      -17.43235        6.83885        6.13610
  F      -29.48798       -1.56692        7.01162
  F       21.17385      -14.24291        6.67381
  I        9.64917       -4.42910        5.79921
  I      -22.99714        9.18391        6.69428
  I      -14.99915       10.66280        6.29625
  C      -16.09297        6.57273        6.26042
  I        8.48240       12.30278        6.18743
  C        6.04920        8.47882        6.02728
  C       -5.14482       -0.18172        5.89977
  I       -2.20420       -3.63446        5.89109
  I       13.15286       -1.65931        6.22239
  C        7.38858        8.21270        6.15160
  I       -3.37097       13.09742        6.27930
  I       11.98609       15.07256        6.61060
  C       -3.85492        0.26159        6.04055
  F       -4.83965      -16.65883        6.51459
  F      -17.08027      -10.31088        6.73531
  F      -26.95602       -0.79098        7.27966
  I        1.65118       -5.90800        6.19725
  I      -10.32869       -3.29928        6.33121
  I      -11.49546       13.43259        6.71942
  F       17.47512        1.71302        6.79398
  F       -2.30770      -15.88288        6.78263
  I        0.48441       10.82388        6.58546
  F       20.00708        2.48896        7.06202
  F        6.40128       -8.67091        6.62649
  F      -14.46431      -10.73963        6.97539
  F      -18.24705        6.42100        7.12352
  F        9.01724       -9.09966        6.86657
  F       -6.00643        0.07305        6.90280
  F        5.23450        8.06097        7.01470
  F      -15.63108        5.99225        7.36361
  F        7.85047        7.63222        7.25479
  F       -3.47447        0.84899        7.17084
