1999
XYZ file for : NL9811 in space group C2/c
  C      -18.72027       11.38508      -21.66545
  H       10.49064       15.44654      -21.16210
  S      -19.96409       10.92964      -20.49723
  C       10.22772       15.80707      -20.34640
  C        9.12521       16.61016      -20.27187
  H      -17.57945        9.41206      -19.97365
  C      -18.94489       10.57568      -19.08342
  H       11.70383       14.99492      -19.27324
  C      -17.84237        9.77259      -19.15795
  C       10.94819       15.53132      -19.20693
  C        8.75846       17.08194      -19.05330
  H        8.00398       17.62184      -18.96573
  C       13.74424        9.54903      -19.01781
  C       11.76814       10.79099      -18.61180
  H      -20.06611       11.58737      -17.77728
  C      -19.31164       11.04747      -17.86485
  C      -17.12191        9.49685      -18.01848
  H      -16.36626        8.96045      -18.08479
  N       10.60317       16.00974      -18.01867
  C        9.50382       16.75796      -17.96635
  C        9.22392        5.08976      -18.48440
  C       12.75276        9.94473      -18.14676
  C        7.24781        6.33172      -18.07840
  H       16.86629       15.58054      -17.13242
  C       16.15841       14.98570      -17.02763
  H       14.71366       16.35998      -16.94572
  C       16.38067       13.62908      -16.99176
  H        9.23165       17.07692      -17.13654
  C       14.85639       15.44171      -16.90178
  C      -18.56628       10.72348      -16.77790
  N      -17.46692        9.97527      -16.83021
  C       15.31337       12.80053      -16.83549
  H       15.43733       11.88032      -16.80371
  N       13.80697       14.65819      -16.72504
  C       14.05179       13.32300      -16.72367
  F       10.10884        8.40871      -17.13788
  O       12.83941       17.69983      -16.36553
  C        9.20213        4.71258      -17.15216
  H       13.33425       12.73993      -16.64546
  H        9.87675        4.15061      -16.84378
  O       10.96293       13.30116      -16.42553
  S       12.88822        9.35379      -16.50626
  H      -18.83845       11.04245      -15.94809
  C        7.31667        5.90246      -16.75928
 Cd       11.77174       15.53230      -16.07546
  N       11.96062       18.34084      -15.73176
  O       12.02567       19.55452      -15.62439
  O        8.94970       12.63398      -16.17729
  N        9.78976       13.50006      -16.03721
  C       10.14461        9.24322      -16.10961
  N        8.27144        5.10387      -16.28941
  H      -11.20380        9.54607      -15.94397
  H      -12.79365       -4.17396      -16.02009
  H      -13.35643       10.32550      -15.75727
  H        6.65839        6.18924      -16.16887
  C      -11.91169        8.95123      -15.83918
  S      -10.07961        6.88050      -15.97243
  C      -13.21371        9.40724      -15.71333
  C       11.37632        9.83503      -15.75241
  C      -11.68942        7.59461      -15.80331
  O        9.52811       14.64559      -15.52873
  O       11.01364       17.71308      -15.23093
  N      -14.26313        8.62372      -15.53659
  F        7.86334        8.93537      -15.82447
  C      -12.75673        6.76606      -15.64704
  C      -14.01830        7.28852      -15.53522
  H      -12.63277        5.84585      -15.61525
  C       -9.03827        8.26865      -15.70387
  H      -14.73584        6.70546      -15.45701
  O      -17.10717        7.26669      -15.23708
  O      -15.23069       11.66535      -15.17707
  O      -19.12040        6.59951      -14.98884
  C       15.73399        1.94530      -15.25337
  C        9.00565        9.52862      -15.42572
  N      -18.28034        7.46559      -14.84876
 Cd      -16.29836        9.49782      -14.88701
  C      -13.05658       -3.81342      -15.20440
  C      -14.15909       -3.01033      -15.12986
  N      -16.10947       12.30636      -14.54331
  O      -16.04443       13.52005      -14.43594
  O      -18.54198        8.61112      -14.34028
  C       11.35504       10.66688      -14.67421
  O        9.34704        2.48242      -14.86901
  C      -19.06445        3.49414      -14.23727
  O      -17.05646       11.67861      -14.04247
  O       10.83257        5.54990      -14.57120
  F       12.49735       11.26014      -14.27546
  H       13.70229       14.00626      -13.93106
  C        8.98436       10.36047      -14.34752
  O        8.33502        0.64098      -14.47554
  N       12.08924       15.09162      -13.81052
  N       15.38897        2.42372      -14.06511
  H       -8.96496        4.29519      -14.32793
  N        8.40006        1.85466      -14.36817
  C       14.28962        3.17194      -14.01279
  C       10.21608       10.95228      -13.99032
  H      -11.58047       -4.62557      -14.13123
  C      -12.33611       -4.08917      -14.06492
  N       10.57092        6.69544      -14.06272
  C       14.89040        7.60346      -13.78023
  C      -14.52584       -2.53855      -13.91129
  H      -15.28032       -1.99865      -13.82372
  O       11.41099        7.56152      -13.92264
 Cd        8.58894        4.66320      -14.02448
  S      -11.52469        3.30542      -13.89800
  C       13.04402       14.29304      -13.34065
  F       -3.89358       -4.99777      -14.04148
  H       10.48393       16.04490      -13.25615
  C      -19.08574        4.32600      -13.15907
  S        7.47246       10.84171      -13.59367
  O        9.39776        6.89434      -13.67440
  O        7.52127        2.49567      -13.73440
  F      -12.78249        0.62426      -13.45375
  C       19.64219        1.85569      -12.94822
  C       11.15855       15.48292      -12.94778
  F       14.89463       -5.17731      -13.18432
  C       -8.91209        3.86082      -13.50836
  H        7.02643        7.45557      -13.45447
  F       -2.36930       -2.90532      -13.60319
  C       14.89607        9.78483      -12.93542
  C        6.30889        6.87251      -13.37626
  C      -17.85402        4.91781      -12.80187
  C       18.83759       -0.26302      -12.77011
  N        6.55371        5.53731      -13.37489
  N       18.59277        1.07217      -12.77148
  F       10.25185       11.78679      -12.96205
  C        5.04732        7.39497      -13.26444
  S      -20.59764        4.80723      -12.40522
  C       13.98812        7.24270      -12.82413
  H       -6.97604        4.21569      -13.22125
  N      -15.98085        9.05715      -12.62207
  H      -14.36780        7.97179      -12.74261
  C        5.50430        4.75379      -13.19815
  F       13.55650        5.97980      -12.78851
  C      -13.78048       -2.86253      -12.82434
  N      -12.68113       -3.61075      -12.87665
  H       11.12903        3.11858      -12.96339
  H        5.64702        3.83552      -13.15421
  C      -10.01299        3.26182      -12.97990
  C        4.20228        5.20980      -13.07231
  O       17.62521        4.11381      -12.41196
  C      -12.70001        2.83286      -12.68195
  F        1.40857       -7.59085      -12.91287
  O       15.74872       -0.28486      -12.47197
  C       -7.72174        3.82507      -12.83101
  C      -13.17969        1.56899      -12.59178
  H      -17.58616       10.01042      -12.06770
  C       -3.68881       -4.62736      -12.77099
  C       13.11287       13.86378      -12.02154
  C      -15.02608        8.25856      -12.15220
 Cd       16.55754        1.94628      -12.12190
  C       14.93040       -4.34280      -12.15605
  O       -2.69528        5.03099      -12.53924
  C       13.98830        9.43407      -11.97240
  C       -2.89247       -3.54258      -12.55310
  C      -16.91155        9.44845      -11.75933
  N       14.57556       -0.08596      -12.08365
  H       13.81459       13.32345      -11.73281
  H       -3.79566       -0.79240      -12.43643
  C       13.50426        8.14829      -11.90407
  N       16.74642        4.75482      -11.77820
  H      -14.05265       -2.54357      -11.99453
  H        9.25753        9.09415      -12.05854
  C       10.85686        3.43754      -12.13358
  O       -4.70611        4.34741      -12.31758
  C       16.16212       -3.75099      -11.79885
  C       11.13677       15.10574      -11.61553
  N        9.75751        4.18576      -12.08127
  C        7.60792       10.25077      -11.95317
  F       12.64913       -4.65065      -11.87091
  H       -5.20394        0.99247      -12.16343
  F      -12.72747        5.02607      -11.77360
  C      -13.17403        3.75036      -11.74697
  H       -6.41801       -4.03995      -11.99041
  C      -14.08197        1.20822      -11.63568
  F      -14.51360       -0.05468      -11.60006
  C       -7.12589       -4.63479      -11.88561
  C       -6.90363       -5.99141      -11.84975
  O       14.31391        1.05958      -11.57518
  C       -9.89742        2.63439      -11.76166
  H       -8.57064       -3.26051      -11.80371
  C       -8.42791       -4.17878      -11.75977
  C       -7.97093       -6.81996      -11.69348
  H       -7.84697       -7.74017      -11.66169
  C       13.79144       -4.05740      -11.47216
  C       12.12139       14.25949      -11.15048
  N       -3.61313        4.69649      -11.81738
  O       15.79944        4.12706      -11.27737
  C       -9.23250       -6.29750      -11.58166
  C       -4.25247       -5.31737      -11.75031
  C        8.59255        9.40451      -11.48813
  C        1.17265       -7.05758      -11.72332
  N       -9.47733       -4.96230      -11.58303
  H       -9.95004       -6.88056      -11.50345
  H       10.47178       15.41611      -11.04513
  N       -7.58665        3.23977      -11.61369
  F       13.56053       10.37001      -11.11262
  C       -3.67075       -0.20973      -11.72274
  C      -20.46217        4.21630      -10.76472
  H        5.91472       11.18680      -11.37085
  O      -12.32137       -6.31933      -11.28352
  F        3.41478       -6.48221      -11.57469
  H      -18.81257        3.05967      -10.87008
  H      -10.63107        2.21560      -11.37142
  C       -4.50878        0.86942      -11.55950
  O      -14.33460       -6.98651      -11.03528
  H       12.35670        2.57366      -11.13420
  O      -10.44489       -1.92066      -11.22351
  C      -14.95722        7.82931      -10.83309
  O        2.80685        2.74329      -11.41383
  C        6.61644       10.64647      -11.08212
  N      -13.49454       -6.12043      -10.89520
  C       11.60222        3.11356      -11.04663
  H      -22.15537        5.15233      -10.18240
  C       -2.60648       -3.09593      -11.28053
  C       16.14084       -2.91913      -10.72065
  C       -8.66359        2.64438      -11.13191
  C       -0.13849       -7.10660      -11.20039
 Cd      -11.51256       -4.08819      -10.93345
  C      -14.08180        3.39960      -10.78395
  C      -16.93333        9.07127      -10.42708
  S       12.26044        7.69285      -10.73585
  C      -14.56584        2.11381      -10.71562
  C      -19.47755        3.37004      -10.29968
  H       -7.79412        6.02492      -10.94871
  C        9.41249        4.66418      -10.89300
  C        2.18648       -6.48780      -11.02055
  H      -14.25551        7.28898      -10.54435
  H        8.65685        5.20058      -10.82669
  S       -1.49260       -1.75252      -11.00893
  F       17.28315       -2.32588      -10.32190
  C      -21.45366        4.61200       -9.89367
  H       -8.13611        8.27743      -10.60172
  N      -11.32367       -1.27965      -10.58975
  O      -13.75619       -4.97489      -10.38672
  C       -2.65524       -0.41824      -10.83318
  C       13.77016       -3.22555      -10.39396
  H       14.64507        6.17527      -10.21227
  O      -11.25863       -0.06597      -10.48239
  H      -17.59831        9.38164       -9.85667
  H       18.48809        0.42024       -9.97750
  F        9.47747       12.72346      -10.14161
  C      -15.94870        8.22501       -9.96203
  O       -3.51248        4.65121      -10.54180
  N       -4.36063        1.73635      -10.56633
  H       -4.17916       -9.29083      -10.37437
  C       -7.24330        6.47251      -10.34836
  C       15.00188       -2.63374      -10.03677
  C       -3.97909       -4.86364      -10.46187
  C        8.57077        9.02733      -10.15588
  N       16.87504        1.50561       -9.85696
  H       -8.59044        2.20160      -10.31698
  F      -14.50956        4.33554       -9.92417
  O      -12.27066       -1.90741      -10.08891
  C       -7.44841        7.83289      -10.15767
 Cd       -5.72980        3.58476      -10.28654
  N        2.63132        2.28469      -10.29685
  C       -3.17904       -3.77679      -10.23133
  S       12.25685       13.66855       -9.50999
  H        9.24538        8.46536       -9.84751
  F       -4.00860       10.30992       -9.87015
  C       11.23548        3.58534       -9.82806
  S      -15.80966        1.65838       -9.54740
  C       17.82982        0.70702       -9.38709
  C        6.68530       10.21722       -9.76301
  O        1.71022        1.48003      -10.08286
  C       -0.32429       -6.52321       -9.98381
  C       10.13296        4.38843       -9.75353
  F       -7.99669      -12.96176       -9.50019
  S       12.25826       -2.74431       -9.64011
  H        1.53468       -3.32036       -9.95630
  C       14.38215        6.53581       -9.39657
 Cl        5.50755        6.67208       -9.77343
  C        2.00067       -5.90441       -9.80397
  N       -6.30267        5.77058       -9.72177
  C       -2.48902        0.48033       -9.82973
  H       15.26973        2.45888       -9.30259
  C      -19.49933        2.99286       -8.96743
  C       13.27963        7.33889       -9.32204
  F      -18.59263        6.68899       -8.95316
  C       -4.12630       -9.72519       -9.55480
 Cl        4.46010        7.44719       -9.60673
  C       -3.34095        1.53265       -9.73572
  C        9.51324       13.55797       -9.11333
  C      -21.38480        4.18275       -8.57456
  N        7.64007        9.41863       -9.29314
  C       15.94435        1.89690       -8.99422
  C       -6.61351        8.50725       -9.29365
  H        1.30969       -1.07095       -9.53952
  F       23.54515        5.35146       -8.23366
  F       -1.55260       -6.52880       -9.42967
  F       15.03765       -1.79923       -9.00849
  F       -4.51922       -5.49990       -9.39839
  H        6.02702       10.50400       -9.17259
  H       -2.19024       -9.37032       -9.26769
  H      -18.82471        2.43089       -8.65906
  C       10.74496       14.14978       -8.75614
  S       -6.91325       10.22088       -9.11371
  H      -13.42502        0.14080       -9.02381
  O        3.36603        2.62831       -9.33406
  C        2.09284       -2.90067       -9.34293
  C        0.68953       -5.95342       -9.28104
  O       -2.61032       20.64406       -8.37112
  F        7.23197       13.25012       -8.82820
  C       -5.22719      -10.32420       -9.02634
  C        4.31882        5.71658       -9.16418
  H       -1.79806        0.37450       -9.21348
  H        9.87004        4.74896       -8.93783
  F       -0.61190        8.29167       -8.99600
  C       -7.91421      -10.75316       -8.72839
  C       -8.39389      -12.01703       -8.63822
  H      -22.04308        4.46952       -7.98414
  C       -2.93594       -9.76095       -8.87745
  C        1.97143       -1.54490       -9.08842
  H       -3.20541        2.14740       -9.05154
  H       -9.58200       -5.61423       -8.78905
  N      -20.43002        3.38416       -8.10469
  C       -5.52641        6.43467       -8.87322
  C        8.37428       13.84337       -8.42945
  S      -15.81324        7.63408       -8.32154
  F       -2.94308       -3.40190       -8.96564
  N      -11.19506       -4.52886       -8.66851
  C       -4.24451       10.84319       -8.68061
  H       15.85826        5.72365       -8.32341
  H        0.99014      -14.37842       -8.48287
  S        3.35826       -5.33112       -8.84793
  H       -0.34957        2.74236       -8.91011
  C       15.10262        6.26006       -8.25710
  F       -2.00239       11.41856       -8.53198
  C       -5.64782        7.79044       -8.61872
  C      -18.55686        7.52350       -7.92488
  F        0.96424       10.38967       -8.56326
  H       -1.75693        4.51527       -8.74817
  C       17.89867        0.27776       -8.06798
  S       12.25467        3.23138       -8.41425
  O        2.09052       -8.55503       -8.58568
  O       -6.92101        2.26145       -8.62758
  F      -20.83813        7.21565       -7.63975
  C        3.05852       -3.61748       -8.66800
  C      -13.68795        0.50133       -8.20812
  C      -14.79046        1.30442       -8.13359
  C       12.91289        7.81068       -8.10347
  H       14.04333       -4.49187       -8.10497
  H       -0.41814      -12.59354       -8.20988
 Cl        3.11424        6.69028       -8.43762
  H       18.60039       -0.26256       -7.77925
  O        0.07969       -9.23861       -8.36402
  H       -4.86467        5.96072       -8.42213
 Cl      -10.88293        3.41416       -8.26317
  H      -12.80037       -3.57559       -8.11414
 Cl       -9.64415        4.90285       -8.24572
  H       12.15841        8.35058       -8.01590
  C      -10.24028       -5.32745       -8.19864
  C       -5.55566       10.79418       -8.15768
  C       10.72367       14.98164       -7.67794
  C      -17.32514        8.11531       -7.56768
  C       12.39372       -3.33525       -7.99962
  F       10.95458        0.55423       -8.03748
  C       23.74992        5.72187       -6.96317
  C       -3.23069       11.41298       -7.97784
  F       -9.72780      -13.64069       -7.64650
  N        2.74769       -0.88081       -8.23988
  C       -0.21403        3.35712       -8.22593
  C      -19.69582        7.80890       -7.24100
  C       15.92257        1.51972       -7.66197
  C       -9.29618      -12.37779       -7.68212
  H       -5.08967        8.21012       -8.00535
  C       24.54626        6.80664       -6.74528
  C        1.11504      -13.79575       -7.76918
  N       -2.78585       20.18547       -7.25413
 Cl      -10.71405        2.47060       -7.91178
  C       -1.06597        4.40943       -8.13191
  C      -12.12575       -4.13757       -7.80576
  C       -8.38823       -9.83566       -7.79341
  F        0.45362       -5.42016       -8.09150
  O        8.71567        6.79717       -7.87273
  F       11.86598       15.57489       -7.27919
  C       -5.11163      -10.95163       -7.80810
  F       -7.94167       -8.55995       -7.82004
  C      -27.64599        3.71893       -6.31133
  N        1.17267       -8.88953       -7.86381
  O       10.20120        9.86466       -7.57492
  C        8.35299       14.67522       -7.35125
  C       13.37834       -4.18150       -7.53457
  C        0.27702      -12.71659       -7.60594
  O       -5.26520        3.40973       -7.87879
  N       -2.80085      -10.34624       -7.66012
  O       -3.70695       19.38081       -7.04015
  C       -0.37594        8.66655       -7.73032
  C        3.89343       -2.94313       -7.80398
  C       16.90719        0.67347       -7.19692
 Cl        3.25117        5.96505       -7.73222
  H       -5.84527      -11.37042       -7.41786
  N       -6.18630        2.60507       -7.66480
  C        9.58471       15.26703       -6.99405
  H        5.03546        2.68817       -7.64467
  C        0.42411        9.75340       -7.49978
  H       -9.59633        8.60995       -7.33166
 Cd        2.17482        1.30501       -7.67510
  H       10.70052       -2.39922       -7.41729
  O        7.70365        4.95574       -7.47926
  N       14.75760        6.73848       -7.06883
  C        3.68832       -1.58275       -7.61329
  H       15.25758        1.83009       -7.09157
  N        7.76869        6.16942       -7.37190
 Cl       -8.69279        4.78445       -7.34758
  C       13.65825        7.48670       -7.01652
  N        9.93956       11.01020       -7.06645
  C       11.01085        2.77595       -7.24603
  O      -19.35443        0.76270       -6.68428
  O       10.77962       11.87628       -6.92637
  C       -3.87779      -10.94164       -7.17835
  H      -12.21183       -0.31082       -7.13496
  C      -12.96748        0.22559       -7.06865
  C       11.40224       -2.93955       -7.12856
  C      -15.15721        1.77621       -6.91502
  H        4.58113       -3.38767       -7.35993
  C       10.52681        1.49016       -7.17770
  H       -3.88248       14.58041       -6.91358
  O       -0.04250        0.23855       -7.41985
  N        0.80564        3.15342       -7.39532
  H      -15.91168        2.31611       -6.82745
  S      -12.15606        7.62017       -6.90173
 Cd        7.95757        8.97796       -7.02820
  C      -17.34643        8.94716       -6.48949
  S       22.14492        3.64371       -6.21104
  C        2.13056      -14.00426       -6.87962
  C       -5.74146       11.37756       -6.94110
  C       -9.78004      -11.47220       -6.76206
  H       21.02072        6.30928       -6.18259
  C       -9.29600      -10.18641       -6.83039
  O       -2.05114       20.52909       -6.29135
  O      -20.36645       -1.07874       -6.29081
  S        6.84109       15.15646       -6.59740
  C       23.18626        5.03185       -5.94249
  C      -19.71711        8.64075       -6.16280
  C       -0.89974        5.30801       -7.12846
  C      -10.17142       -5.75671       -6.87953
  H       -4.10748       16.82982       -6.49681
  C       -9.86498        3.71590       -6.92163
  H       -3.00832       -7.56110       -6.99515
  O      -17.86890        3.83019       -6.38647
  O        8.76639       11.20909       -6.67813
  N      -20.30141        0.13494       -6.18345
  C       -3.41649       11.99636       -6.76126
  F       -4.52495       -0.68302       -7.04521
  C       20.31284        5.71444       -6.07779
  S       -2.06239        6.64228       -6.95272
  H        4.23914       -1.13516       -7.01294
  C       20.53510        4.35782       -6.04193
  H       -7.17409       22.41604       -5.70545
  O        6.88990        6.81043       -6.73813
  N        0.42517      -11.84967       -6.61277
  F      -13.41385        4.93901       -6.45748
  H       18.86809        7.08871       -5.99589
  H       -5.76674       20.64313       -5.86740
  C        5.10861        2.24538       -6.82974
  F      -16.20412        9.54042       -6.09074
  H       -9.46971       -6.29704       -6.59080
  C       -9.54346        8.17558       -6.51209
  H        6.39506       11.77033       -6.45820
  C       19.01082        6.17044       -5.95195
  C      -12.14753       -4.51475       -6.47352
  C       -3.32433       15.00010       -6.30022
  C       -0.94850        7.98569       -6.68112
  F       -6.96977       11.37198       -6.38696
 Cd      -20.11252        2.94349       -5.83975
  O        1.27332       -8.93481       -6.58824
  C      -18.48539        9.23256       -5.80560
  C       19.46780        3.52927       -5.88566
  F        9.62048       16.10154       -5.96578
  C      -27.37261        4.17266       -5.02289
  N        7.41711      -11.30132       -6.34329
  H       19.59175        2.60906       -5.85388
  H       -3.35031       -5.30858       -6.64816
  C        5.67752       11.18726       -6.37999
  H       13.38608        7.80565       -6.18671
  H        7.07609        2.67417       -6.59023
  H        4.29199       12.62993       -6.29995
  H       -3.80465      -11.38442       -6.36342
  F       10.95862        4.94444       -6.36159
  N      -18.13054        4.97572       -5.87800
  C       -3.44574       16.35587       -6.04571
  N        5.92234        9.85206       -6.37862
  C       13.35656       -4.55869       -6.20232
  O       -6.36183        2.14647       -6.54782
  F       14.26327       -0.86255       -6.18805
  F       -3.00067        1.40943       -6.60692
  C        4.41595       11.70972       -6.26817
  S      -21.22900        9.12199       -5.40895
  C       -4.72764       11.94735       -6.23832
  C       10.52699        3.68154       -6.32596
  N       17.96140        5.38693       -5.77521
  O      -21.18019        0.77595       -5.54968
  C       18.20622        4.05173       -5.77384
 Cd       -0.94401      -10.00126       -6.33298
  O        6.49602      -12.10598       -6.12930
  C       -2.45751       -7.11350       -6.39480
  H       -7.60741        8.53045       -6.22498
  O      -17.29048        5.84180       -5.73792
  H      -23.77811        6.59546       -5.11150
  C        0.69749       10.20714       -6.21134
  C        4.87293        9.06855       -6.20188
  C        0.95380        4.02034       -6.40215
  C        9.61905        1.13941       -6.21468
  C      -23.65415        5.67525       -5.07971
  H       17.48868        3.46867       -5.69563
  H      -21.67504        5.73585       -5.26974
  C        3.34864       10.88117       -6.11190
  H       14.03118       -5.12066       -5.89395
  S      -26.33127        5.56081       -4.75433
  O      -19.30371        5.17462       -5.48968
  N        4.03166        1.64999       -6.34796
  C      -22.39258        5.15279       -5.19154
  F        9.17249       -0.13630       -6.18804
  F       -9.72376       -9.25048       -5.97061
  C      -10.64436        7.57657       -5.98362
  H        5.01565        8.15028       -6.15794
  C      -24.72145        4.84670       -4.92345
  C      -11.16291       -5.36100       -6.00847
  H       10.49766        7.43334       -5.96712
  N      -22.14775        3.81759       -5.19017
  H      -12.81251       -4.20438       -5.90311
  C       -6.48313       22.31020       -5.08920
  C        3.57091        9.52455       -6.07604
  C      -14.41185        1.45222       -5.82807
  C        6.34244        2.25537       -6.19999
  C        0.11577        5.09950       -6.23891
  C       -2.66261       -5.75313       -6.20411
  N      -13.31249        0.70400       -5.88038
  C       -5.63120       21.25789       -5.18322
  C      -24.49919        3.49008       -4.88758
  C        2.29678      -13.10568       -5.87618
  C      -23.19717        3.03408       -5.01343
  S        1.73882       11.59528       -5.94278
  H      -25.20707        2.89525       -4.78279
  O       16.99384        8.42856       -5.41569
  S       17.04265        0.08253       -5.55643
  C      -13.33138        7.14762       -5.68568
  S      -11.02386      -11.92764       -5.59384
  H      -23.05445        2.11580       -4.96948
  S       -2.05890       12.56965       -5.80522
  H        2.86302        8.92972       -5.97124
  N        0.05815        0.19328       -6.14427
  C       -8.35311        8.13982       -5.83474
  C       11.47109       -3.36880       -5.80945
  C        1.44485      -12.05337       -5.78216
  C      -13.81106        5.88374       -5.59550
  C       -2.35864       14.28329       -5.62529
  O       15.11736        4.02990       -5.47570
  C       23.45964        5.48559       -4.65405
  F        0.77720       -3.27610       -5.91659
  N       -1.51687       -7.81544       -5.76821
  N       -2.66948       17.01996       -5.19717
  C       24.25969        6.57244       -4.42351
  H        1.64896        3.89729       -5.79821
  C       -4.32018       -0.31261       -5.77471
  C      -27.93627        3.48265       -4.00221
  O        8.15182      -10.95771       -5.38050
 Cd       15.92617        6.26103       -5.12562
  F      -18.44962       10.06707       -4.77732
  O       -3.32665        9.34574       -5.54297
  C        6.75722      -15.13092       -5.13486
  N       12.42587       -4.16739       -5.33958
  H        2.98774      -13.21152       -5.25992
  H       -8.63923      -13.44522       -5.07025
  O        1.15113        0.54235       -5.64407
  O       13.10413        3.36272       -5.22746
  H        8.62616       13.40890       -5.06226
  C       14.29904       -0.02804       -5.15977
  C        9.62471        3.32078       -5.36987
  H        0.24068        5.68217       -5.52522
  C       -3.52384        0.77217       -5.55683
  C       -0.66251        8.43235       -5.40854
  N       13.94419        4.22880       -5.08738
  H       -0.38171       20.58894       -4.60196
  N       16.11506        9.06957       -4.78193
  O       -5.33748        8.66217       -5.32131
  C        6.97655       14.56552       -4.95690
  F      -13.80683       -6.89702       -4.99960
  H       -4.42703        3.52235       -5.44016
  C       10.22550        7.75230       -5.13731
  O       16.18009       10.28325       -4.67456
  H       10.81282       -3.08202       -5.21904
  H      -14.68402        1.77118       -4.99825
 Cd       -3.24235       19.20578       -4.63239
  H      -17.57243        1.39886       -4.77867
  C        9.14503        2.05690       -5.27970
  F       -4.96355       12.48062       -5.04878
  N        9.12614        8.50052       -5.08499
  O       -0.85970       -0.14122       -5.42241
  N       -4.61152       21.05419       -4.35260
  S       -7.47955       24.54305       -3.91001
  C       -1.82771       -5.07877       -5.34009
  C       -6.31691       23.20878       -4.08575
  H        1.58039      -11.43862       -5.09798
  C        0.13383        9.51713       -5.19066
  F      -13.35884        9.34082       -4.77733
  C       15.53075        0.56377       -4.80258
  C      -13.80540        8.06511       -4.75070
  H       -5.83531        5.30723       -5.16716
  C       -1.52374       14.95764       -4.76126
  H        4.43623      -10.84366       -4.95655
  F       12.01777       -0.33590       -4.87464
  C      -14.71334        5.52298       -4.63941
  S       -2.12745       -3.36513       -5.16016
  O       -5.45967       18.13932       -4.37713
  C       -1.72885       16.31802       -4.57058
  C        4.16676        1.06470       -5.13064
  F      -15.14497        4.26008       -4.60379
  F        4.17390       -5.29435       -5.04244
  C      -10.52879        6.94915       -4.76539
  S       -5.92518       -2.39077       -5.02259
  H       -7.04937        0.27480       -4.99414
  C        6.45800        1.62794       -4.98175
  O       13.68254        5.37433       -4.57890
  C        7.96118       13.71927       -4.49186
  N       -4.24450        9.01124       -4.82110
  C       -0.74061       -7.15135       -4.91966
  C       -7.75726       -0.32003       -4.88934
  H        3.02887       -9.07075       -4.79461
  H       -9.20200        1.05424       -4.80744
  C       -7.53500       -1.67665       -4.85348
  H        5.28336       15.50156       -4.37458
  O       -2.13521      -11.32456       -4.67403
  O       15.16807        8.44182       -4.28109
  C       -9.05928        0.13597       -4.76350
  C      -21.09354        8.53105       -3.76845
  N       -8.21802        7.55453       -4.61741
  N        7.53348      -14.46683       -4.28632
  C       -8.60230       -2.50520       -4.69721
  C       13.16008        0.25735       -4.47589
  H      -19.44394        7.37443       -3.87381
  H       -8.47834       -3.42541       -4.66542
  F       22.91950        4.84932       -3.59057
  C       -8.90215      -13.08469       -4.25456
  N      -10.10870       -0.64754       -4.58676
  C       -9.86387       -1.98274       -4.58539
  C       -4.88384       -1.00262       -4.75404
  C       -4.30212        4.10502       -4.72646
  H       -0.83604       14.51310       -4.31721
  H      -10.58141       -2.56581       -4.50718
  H        3.42106        0.67407       -4.74040
  H      -11.26244        6.53035       -4.37515
  C      -10.00466      -12.28160       -4.18003
  C        0.54128       -2.74283       -4.72705
  F        9.22750        4.26550       -4.50790
  C       -0.86203       -5.79558       -4.66516
  N      -18.94396        2.46604       -3.89654
  S      -11.02745       -5.95194       -4.36798
  C       -0.30856       20.14616       -3.78703
  F        5.75004       -3.19635       -4.60970
  C       -5.14015        5.18418       -4.56323
  C      -17.84460        1.71782       -3.94886
  O      -12.95274       -2.00458       -4.28725
  C        5.98507       14.96123       -4.08585
  C        8.67922      -16.52915       -3.85042
  H       -1.17803       16.76562       -3.97023
  F        2.78341       -2.16746       -4.57842
  H       -0.07887       -7.62530       -4.46856
  H      -22.78674        9.46708       -3.18613
  O      -14.96597       -2.67176       -4.03901
  H       11.72533        6.88841       -4.13793
  C        4.57177      -10.22890       -4.27237
  O        2.17548        7.05805       -4.41756
  H        1.65892       20.57494       -3.54752
  C        5.35711        1.02894       -4.45328
  O      -11.07625        2.39409       -4.22724
  C       -4.46337       21.92111       -3.35943
  F       -1.18568        7.79509       -4.35846
  C      -13.77106       -6.06251       -3.97132
  C       -5.30140       23.00027       -3.19620
  C       10.97085        7.42831       -4.05036
  C       -9.29496        6.95914       -4.13564
  O       13.50147       -6.78885       -3.91917
  C      -14.71316        7.71436       -3.78768
  C        3.71983       -9.17659       -4.17835
  F      -16.05233       -6.37037       -3.68619
  C      -20.10892        7.68480       -3.30341
  N      -14.12591       -1.80568       -3.89893
  H       -8.42549       10.33968       -3.95243
  C        8.47412      -15.16877       -3.65973
  C      -15.19721        6.42857       -3.71935
  C       -3.23785        1.21883       -4.28426
  C       15.50947        1.39562       -3.72438
 Cd      -12.14393        0.22656       -3.93717
  C        8.78113        8.97893       -3.89673
  C       -0.76986       -2.79184       -4.20412
  S        7.96971        1.58435       -4.06365
  C      -22.08503        8.92675       -2.89740
  C        5.67863        5.48862       -4.04375
  H        8.02548        9.51534       -3.83042
  N       -1.38550       19.55077       -3.30525
 Cd        6.96062      -12.28101       -3.72154
  O       14.98700       -3.72136       -3.62137
  O       -0.47941      -10.17629       -3.92523
  F        0.33859        9.88754       -3.92017
  H       -8.76748       12.59219       -3.60545
  H       -0.30387       -5.37589       -4.05179
  N       19.54340       -6.84754       -3.11527
  C        0.92527       20.15615       -3.15727
  O       12.48945       -8.63028       -3.52570
  C      -12.53934       -5.47071       -3.61412
  C        1.55511       -2.17304       -4.02428
  S       -2.12396        2.56224       -4.01266
  N       -1.40050      -10.98095       -3.71124
  F       16.65178        1.98887       -3.32563
  N      -11.95504        3.03510       -3.59348
  O        4.74329      -13.34747       -3.46629
  N       -5.35902       18.09405       -3.10156
  N       12.55449       -7.41660       -3.41834
  C       -3.28661        3.89651       -3.83691
  H       -3.76821       21.79806       -2.75550
  C        4.40986       -4.91947       -3.77676
  C      -14.91002       -5.77712       -3.28744
  O      -14.38756       -0.66014       -3.39045
  O      -11.89000        4.24878       -3.48611
  H       -5.17649       23.58294       -2.48251
  C       13.13879        1.08921       -3.39769
  O       -4.14385        8.96597       -3.54553
  H       17.85672        4.73499       -2.98123
  N        5.59144      -10.43260       -3.44176
  C       -7.87467       10.78727       -3.35208
  H       -7.42604      -13.89683       -3.18140
  C        7.93940       13.34209       -3.15961
  N       -4.99200        6.05110       -3.57006
 Cl        4.50644        4.42007       -3.61779
  H        5.40998        0.59457       -3.63372
  C       -8.18168      -13.36043       -3.11509
  C       19.04483       -1.66780       -2.83040
  C       -8.07978       12.14765       -3.16140
  C        5.20991       -3.83261       -3.54622
  F      -15.14093        8.65029       -2.92790
  N       14.72535       -2.57582       -3.11289
  H       -9.22181        6.51635       -3.32070
  H      -20.04461        3.48086       -2.64197
  C      -19.28897        2.94446       -2.70828
  H      -16.34476        0.85394       -2.94948
  F        0.26085      -14.26903       -3.09165
  N       16.24367        5.82036       -2.86069
  C      -17.09924        1.39384       -2.86190
  O       15.56542       -1.70974       -2.97281
  C      -10.37141      -11.80981       -2.96146
 Cd       -6.36117        7.89952       -3.29027
  C       14.37051        1.68102       -3.04049
  C       -4.61046       -0.54889       -3.46560
 Cd       12.74337       -4.60806       -3.07464
  H       -4.81053       -4.97607       -3.37810
  O      -12.90203        2.40735       -3.09264
  H      -11.12589      -11.26991       -2.87389
  O       -4.26604       18.44312       -2.60135
  F       -4.63997       14.62467       -2.87388
  N        1.99995        6.59945       -3.30057
  H        8.61401       12.78012       -2.85124
  C        9.89441      -11.34063       -2.87618
 Cl       -7.43752        3.23947       -3.23315
  C        3.88605       -8.27801       -3.17491
  C        6.05393       14.53197       -2.76674
  C       -3.81041        0.53797       -3.23506
 Cl        6.52770        6.73392       -3.05359
  S      -16.44103        5.97313       -2.55112
  C       10.60411        7.90010       -2.83179
  O       11.67570       -6.77559       -2.78457
  O       -6.27687       17.75955       -2.37970
  N       22.74720       -8.19909       -1.82165
  O        1.07885        5.79479       -3.08659
  O       13.55219       -2.37692       -2.72457
  S       -7.37026       -5.96584       -2.94817
  C        9.50159        8.70319       -2.75725
  C       17.19845        5.02177       -2.39082
  S        2.72341       -6.94374       -2.99916
  C        2.12319      -19.33915       -2.25055
 Cl        4.87618       10.98683       -2.77716
  N       -6.93404       10.08533       -2.72550
  C      -20.13070        7.30762       -1.97116
  F        1.78513      -12.17659       -2.65336
  C       -0.95566       -2.20846       -2.98754
  H        0.90331        0.99440       -2.96002
 Cl        3.82874       11.76194       -2.61046
  S       11.62689        1.57044       -2.64384
  C      -12.56063       -4.63885       -2.53593
  C       -1.25041       18.96547       -2.08793
  C       -3.12039        4.79509       -2.83346
  H       14.63836        6.77363       -2.30632
  N        8.81746      -11.93603       -2.39440
  O       -1.57603      -11.43955       -2.59426
 Cl        6.69658        5.79036       -2.70221
  C      -22.01617        8.49750       -1.57829
  C       -3.97232        5.84740       -2.73945
  F       -8.62806       -8.64700       -2.50392
  N        7.00870       13.73338       -2.29687
  C        3.83730       -5.60033       -2.72756
 Cl        5.45779        4.30167       -2.71966
  C       19.05049        0.51357       -1.98559
  C        1.04084       19.52872       -1.93904
  C        1.36931       -1.58966       -2.80770
  H       11.18086       -1.81569       -2.50464
  C       -7.24487       12.82200       -2.29738
  C      -14.93131       -4.94526       -2.20924
  H        5.39565       14.81875       -2.17632
  S       -7.54462       14.53564       -2.11744
  C        5.73959       -9.56568       -2.44859
  N       10.70814       -3.73396       -2.42506
  C       10.46332       -2.39876       -2.42643
  F        5.56300      -16.86212       -1.96303
  C       -4.75766       -5.41044       -2.55853
 Cl       -7.30059        2.51424       -2.52776
  N        4.84394      -13.39274       -2.19071
  O       19.90315       -9.55612       -1.52214
  C       18.14255       -2.02857       -1.87430
  H      -19.45608        6.74564       -1.66279
  H       15.28346       -6.15268       -2.01356
  C       15.31298        6.21166       -1.99794
  O       21.77964       -5.15745       -1.46213
  F       17.71093       -3.29147       -1.83868
  H        0.67832        3.24380       -2.54325
  H        9.07779       -0.95609       -2.34639
  H      -14.05639        4.45555       -2.02754
  C        9.20175       -1.87630       -2.31461
  C        9.65873       -4.51747       -2.24832
  C        4.90157       -8.48652       -2.28535
  F       14.40628        2.51553       -2.01222
  H       -1.99611       18.57484       -1.69769
  H        9.80145       -5.43574       -2.20438
  N       -8.52670      -12.88201       -1.92682
  F      -11.41832       -4.04560       -2.13718
  F       -5.15059       -1.18515       -2.40212
  O        2.73466        6.94307       -2.33779
  F       -2.18397       -2.21404       -2.43340
  C        3.68745       10.03134       -2.16791
  C       -9.62605      -12.13379       -1.87451
  C      -18.56850        2.66871       -1.56880
  F       -1.24327       12.60642       -1.99973
  C        1.46147        1.41408       -2.34666
  C      -17.46599        1.86563       -1.64334
  H      -22.67444        8.78428       -0.98787
  C        5.48328       -3.37888       -2.25778
  H       -2.82161       -5.05557       -2.27142
  C      -13.69959       -4.35346       -1.85204
  H        9.23867        9.06372       -1.94156
  C        8.13444       -2.70484       -2.15834
  C        8.35671       -4.06147       -2.12247
  C        0.05816       -1.63867       -2.28477
 Cd       20.71197       -7.32498       -1.17207
  H       -2.42942        4.68925       -2.21721
  N      -21.06139        7.69891       -1.10842
  C       -4.87588       15.15794       -1.68434
  C        0.46562      -13.89862       -1.82116
  C       -0.06006       18.92971       -1.41057
  C       -6.15778       10.74942       -1.87695
  C        2.95809      -18.66479       -1.38653
  H        7.64882       -4.65630       -2.01768
  C       -5.85856       -6.00944       -2.03006
  H       -3.83678        6.46216       -2.05526
  O        5.93692      -13.04366       -1.69051
  H        6.43475       -9.68873       -1.84465
  S      -16.44321       -4.46403       -1.45539
  F       -2.63375       15.73331       -1.53571
  C        1.34006        2.76985       -2.09215
  S        6.52462       -1.99073       -1.98922
  F        0.33287       14.70442       -1.56699
  C       -6.27919       12.10519       -1.62244
  H      -10.21337       -1.29948       -1.79278
  H       -0.98094        7.05712       -1.91384
  F       -3.57445        0.91286       -1.96937
  C       -8.54558       -6.43840       -1.73212
  C       -8.50517        3.48794       -1.80120
  N      -11.82643       -0.21411       -1.67224
  C        1.26196      -12.81385       -1.60327
  C       -3.56731       -5.44620       -1.88118
  C       -9.02526       -7.70227       -1.64194
  H       -2.38830        8.83002       -1.75190
  S        2.55254       19.48512       -1.02093
  S        2.65835      -16.95115       -1.20660
  S        2.72690       -1.01637       -1.85166
  O       -7.55238        6.57621       -1.63131
  S       11.62331        7.54614       -1.41798
  C       17.26730        4.59252       -1.07170
  C       18.14273        0.16281       -1.02257
  C       15.01129       -5.83372       -1.18375
  C       -6.18703       15.10893       -1.16141
  H        5.02647       -7.90385       -1.57166
  C      -15.42183        5.61917       -1.13731
  H       -5.49604       10.27547       -1.42585
  C      -14.31931        4.81609       -1.21185
 Cl        2.48287       11.00504       -1.44135
  C        8.95255      -12.52132       -1.17708
  H        0.35877      -10.06367       -1.48660
 Cl      -11.51430        7.72892       -1.26690
 Cl      -10.27551        9.21760       -1.24944
  C        2.42715        0.69727       -1.67173
  C       17.65869       -1.12298       -0.95424
  S       -1.13938      -15.97678       -1.06903
  N       13.91194       -5.08550       -1.13143
  O        1.45915       -4.24027       -1.58941
  C        3.92377      -19.38160       -0.71160
  H      -18.83143        3.02925       -0.75311
  H       -9.89822      -11.81483       -1.04470
  C       -3.86206       15.72773       -0.98157
  O       18.46834       -8.21169       -0.62534
  H       17.96902        4.05219       -0.78297
  C        4.12329       -5.15367       -1.45499
 Cl       -8.64645        1.75733       -1.35864
  H      -13.43174        0.73916       -1.11787
  H       13.41196       -0.17712       -1.10870
  C      -10.87165       -1.01270       -1.20237
  H       -2.26358      -13.31122       -1.04058
  C       -2.74920      -15.26267       -0.89992
  C        5.32708      -16.32885       -0.77349
  H       -5.72104       12.52488       -1.00908
  O       -0.55168       -4.92385       -1.36775
 Cl       -9.69390        2.53244       -1.19194
  H       -3.69254      -17.01143       -0.71186
  C       -2.97146      -13.90605       -0.93578
  H       -0.00719       18.49535       -0.59100
  C       -3.81650      -16.09122       -0.74365
  H       -1.04951       -8.27879       -1.21360
  C       -0.84540        7.67187       -1.22966
  F       10.32321        4.86898       -1.04121
  F        7.56921      -15.75348       -0.62486
  C        4.91963       -4.06889       -1.23710
  C       11.76235        0.97951       -1.00334
 Cl      -11.34542        6.78535       -0.91551
  C       -1.69733        8.72418       -1.13564
  O        8.08430       11.11193       -0.87646
  O       19.95387       -5.14420       -0.32753
  C       -0.09804      -14.58864       -0.80048
  C       15.29120        5.83448       -0.66570
  F      -13.66382       -3.51895       -0.82377
  N        2.11632        3.43394       -1.24361
  C       -4.27348      -13.45004       -0.80994
  H       -4.41621      -12.53178       -0.85388
  O        9.56983       14.17941       -0.57865
  C       -5.07808      -15.56876       -0.63183
  H       -5.79562      -16.15182       -0.55362
  C      -12.75712        0.17719       -0.80949
  N       -5.32290      -14.23356       -0.63320
  C       -1.00731       12.98131       -0.73404
  O       -5.89657        7.72449       -0.88252
  F      -10.35917       -9.32594       -0.65023
  F       -0.17775       -1.10540       -1.09522
  C       -9.92754       -8.06304       -0.68585
  C       -9.01960       -5.52091       -0.79714
  O       -8.16694      -15.59059       -0.33369
  F       -8.57304       -4.24519       -0.82377
 Cl        2.61980       10.27980       -0.73595
  C       -5.74299       -6.63687       -0.81183
  C        0.48368       -9.48099       -0.77290
  C       -0.20726       14.06816       -0.50351
  O      -10.18017      -16.25777       -0.08545
  H       16.51113       -6.69761       -0.18437
  N        0.54130       -4.57478       -0.86754
  C       12.74698        0.13325       -0.53830
  C        4.01594      -16.37786       -0.25056
  F       17.71496        1.09875       -0.16279
  N       -6.81767        6.91982       -0.66853
  C       16.27582        4.98822       -0.20065
  S      -16.44679        1.51167       -0.22953
  C        3.26206        1.37163       -0.80770
  N        9.30819       15.32495       -0.07018
  H        4.40409        7.00292       -0.64840
  O        7.07228        9.27049       -0.48299
  H       -4.51385       18.89517        0.08269
  O       10.14825       16.19103        0.06990
  N       -3.43222       -6.03149       -0.66385
  C       -0.35435       -8.40184       -0.60967
  C       15.75665       -6.15770       -0.09680
 Cd        1.54345        5.61976       -0.67883
  N        7.13732       10.48417       -0.37563
 Cl       -9.32416        9.09920       -0.35131
  C        6.34091      -15.75906       -0.07072
  N       -9.34011      -15.39169        0.05463
  C        1.54795      -12.36719       -0.33070
  H       14.62621        6.14485       -0.09529
  O      -19.98579        5.07746        0.31199
  O        6.96128       -6.52797       -0.46400
  H       10.06915        1.91554       -0.42102
  O       -6.29046      -11.19193       -0.27368
  C        3.05695        2.73201       -0.61702
  H       -6.47664       -7.05567       -0.42159
  C       10.37948        7.09070       -0.24975
  C       -6.37283       15.69232        0.05518
  C      -15.78858        6.09096        0.08125
  H      -16.54305        6.63086        0.16882
 Cd        7.32620       13.29271       -0.03193
  H      -12.84320        4.00394       -0.13869
  C      -13.59885        4.54034       -0.07238
  N        0.17427        7.46817       -0.39905
 Cd       -7.35813      -13.35946        0.01639
  F        3.60012       -5.79093       -0.40490
  H      -14.65814       -6.21159        0.07975
  C       10.46442       -8.09740       -0.09019
  C      -16.30774       -5.05497        0.18511
  C        9.89544        5.80492       -0.18143
  O       -0.67387        4.55331       -0.42357
  C       -4.04786       16.31112        0.23502
  C       13.56692       -4.60709        0.05683
  S       16.41487       -1.57841        0.21398
  C       10.77087        1.37521       -0.13229
  H       22.64252       -8.85102        0.97233
  H        3.94976        0.92709       -0.36366
  O        8.13502       15.52385        0.31814
  S        2.66183      -11.02378       -0.05910
  C       -1.53111        9.62276       -0.13219
  O      -18.50027        8.14494        0.60980
  C      -10.49635        8.03066        0.07464
  C       -4.50916       -6.62688       -0.18208
  H       12.81128       -4.07068        0.12314
  N      -20.93278        4.44970        0.81282
  S       -2.69376       10.95704        0.04355
  H       -0.02473      -18.56209        0.57546
  C       -3.95569       19.31486        0.69605
  C      -10.80279       -1.44195        0.11675
  C       -9.92737       -5.87166        0.16588
  H        5.76369       16.08508        0.53808
  F       -5.15631        3.63174       -0.04893
  C      -10.41141       -7.15745        0.23421
  O       -9.60176      -14.24616        0.56311
  O        6.25853       11.12518        0.25814
  C      -10.17483       12.49033        0.48418
  H       18.79950       -3.09599        0.73757
  C        1.49919       -9.68951        0.11665
  F       -7.60113       15.68674        0.60931
  C       -4.07711       20.67063        0.95056
  N       21.02947       -7.76566        1.09287
  H        3.60777        3.17960       -0.01667
 Cl        9.29223       -9.16595        0.33577
  F        5.12439       -3.69848        0.03339
  H       -3.63969       -3.24634        0.00112
  C       -1.57987       12.30045        0.31516
  H      -18.00094       -4.11893        0.76743
  N       -7.16924      -10.55092        0.36008
  H        3.66062       16.94469        0.69632
  C        5.04615       15.50202        0.61628
  C        4.47724        6.56014        0.16653
  C      -15.32312       -5.90122        0.65015
  C        0.17534      -14.13490        0.48796
 Cd      -20.74389        7.25824        1.15652
  C       -5.35901       16.26210        0.75795
  N        5.29097       14.16682        0.61766
  N      -18.76191        9.29048        1.11827
  C        3.78458       16.02448        0.72811
  S       -2.58446      -19.55186        1.00539
  C      -12.77890       -0.19999        0.52275
  O       -7.10420       -9.33724        0.46745
  H      -10.10108       -1.98228        0.40548
  F       10.32725        9.25920        0.63468
  H        6.44472        6.98892        0.40604
  C      -17.69061        1.05623        0.93870
  H       -8.23878       12.84520        0.77130
  C      -18.17465       -0.22956        1.00702
  O       -6.99320        6.46123        0.44846
  N       -0.20620       -7.53492        0.38350
  C       21.98425       -8.56424        1.56274
  O      -21.81156        5.09071        1.44659
  F       -3.63204        5.72419        0.38936
  C        9.89562        7.99629        0.67031
  C        0.06612       14.52189        0.78493
  C      -17.29923       -4.65926        1.05616
  H       -3.98168       -0.99383        0.34811
  C        0.97539      -13.04805        0.71850
  C        2.71728       15.19593        0.88437
  C        4.24156       13.38330        0.79439
  F       13.63190        3.45220        0.80822
  C        3.83014      -15.79447        0.96602
  C      -23.02394        9.46754        1.80474
  O        0.64195       -4.62005        0.40803
  O      -19.93508        9.48938        1.50659
  O       -8.11623      -11.17867        0.86092
  C       12.72520       -0.24393        0.79395
  H        4.38428       12.46503        0.83834
  N        6.78575       -6.98657        0.65299
  C        0.32243        8.33510        0.59413
  N      -22.77912        8.13235        1.80611
  C        2.93954       13.83931        0.92024
 Cl       -2.65172      -10.34654        0.72040
  S        1.10746       15.91004        1.05349
  H       -4.43601       -7.06967        0.63285
  H        9.86629       11.74809        1.02915
 Cl       11.31350       -6.85210        0.89997
  C       15.38991       -5.68592        1.12177
  S       -2.69027       16.88441        1.19105
  C        6.15510      -15.17567        1.14586
  C        8.98768        5.45416        0.78160
  C      -23.82854        7.34883        1.98284
  N        3.40030        5.96475        0.64831
  C       -2.99001       18.59805        1.37099
  H        5.68911      -12.59162        0.99354
  C       -0.51560        9.41425        0.75736
  C        0.02813      -18.99646        1.39503
  C       -3.08887       -2.79875        0.60148
  C      -15.04322        5.76698        1.16821
 Cd       -1.57537       -5.68650        0.66329
  F        8.54112        4.17845        0.80823
  N      -13.94386        5.01876        1.11589
  H        2.23166       13.24447        1.02503
  C       -8.98448       12.45458        1.16154
  C        5.71107        6.57013        0.79629
  O        5.86465       -7.79123        0.86697
  H       19.42416       -6.81239        1.64724
  C      -11.79427       -1.04625        0.98780
  C       14.28739       -4.88283        1.19631
  H      -13.44388        0.11037        1.09316
  H       13.39981       -0.80590        1.10232
  F      -10.35513       -4.93573        1.02567
  C       18.53658       -2.73546        1.55326
  C       -3.29398       -1.43837        0.79216
  S       16.41128        4.39729        1.43984
 Cl       10.24359       -9.28435        1.23390
 Cl       11.48238       -7.79566        1.25135
  N       -0.57322        4.50803        0.85200
  H        1.96419      -18.64159        1.68214
  F       27.69958       -3.91981        2.71617
  C       20.09878       -7.37436        1.95562
  C       17.43406       -1.93237        1.62779
  C       10.83973        0.94595        1.18682
  F        2.60183      -15.80006        1.52016
  C        1.66541       -8.79093        1.12010
 Cl        9.66198       -2.59918        1.17640
  S      -11.65523       -7.61288        1.40244
  O       -3.95802       13.66050        1.45331
  C       -1.07276      -19.59546        1.92349
  H        1.01759        8.21205        1.19806
  F       -0.36479      -14.77117        1.55144
  C        4.84396      -15.22469        1.66879
  C        0.81348       -7.73861        1.21411
  C      -18.17448        1.96182        1.85876
  F        0.14583        1.03866        1.07968
  H        5.46412      -10.34221        1.41031
  H        5.14457      -23.64968        2.46696
 Cl       -2.51479      -11.07178        1.42580
  C       -4.95155        4.00215        1.22156
 Cl        8.61453       -1.82408        1.34310
  C        6.24727      -12.17193        1.60690
  N       -2.14824       -3.50069        1.22806
  O       -5.96885       12.97692        1.67496
  C       -1.29388       12.74710        1.58773
  F       -5.59492       16.79537        1.94749
  C        1.21849      -19.03222        2.07238
  H       -0.39069        9.99692        1.47105
  C       -3.75978      -20.02442        2.22144
  O        0.51976        4.85711        1.35221
  C        8.99334        7.63553        1.62640
  C        9.59413       12.06705        1.85896
  N       11.79450        0.14737        1.65669
  C      -15.34490       -6.27840        1.98240
  C       -4.15521        5.08693        1.43944
  C       -2.15511       19.27240        2.23501
  H       -5.05840        7.83711        1.55612
  C       13.66767        4.28671        1.83650
  C       -0.49754       13.83188        1.80561
  N        8.49477       12.81527        1.91128
  H      -15.31538        6.08594        1.99802
  O        7.52046       -6.64295        1.61577
  C       -2.36022       20.63278        2.42569
  C        8.51366        6.37166        1.71657
  S        7.51269      -14.60238        2.10190
  F      -14.43820       -2.58227        1.99667
  C        6.12586      -10.81617        1.86141
  H       14.02447       -4.52230        2.01200
  H       -6.46668        9.62198        1.82911
  O        6.24495      -17.82629        2.36415
  O       -1.49107        4.17353        1.57386
  H       -9.27059       -9.13046        1.92602
  H       10.18145        1.23273        1.77724
  H        2.35637       -8.89676        1.73635
  C       22.05310       -8.99350        2.88185
  H       -5.42757      -14.88550        2.16078
  H        3.73629      -21.86481        2.73996
  C        8.47325       -3.55468        1.78565
  F        1.21135      -12.67316        1.98419
  C       14.89939        4.87852        2.19370
  C      -17.23037       -5.08852        2.37527
  C      -11.16016       11.26390        2.23088
  C       -2.45908       -0.76402        1.65618
  H       20.01269       -3.54761        2.62642
  H      -14.67028       -6.84038        2.29077
  N       -4.87587       13.32600        2.17517
  N       -7.04063      -13.80013        2.28132
  H       22.75482       -9.53383        3.17058
  O        4.23412      -18.50987        2.58581
  C        3.53539        5.37945        1.86563
  C        7.21295      -12.88875        2.28183
  H        0.94902       -7.12386        1.89830
  F       11.38640        3.97886        2.12163
  C       19.25705       -3.01120        2.69273
  H       -7.68074        4.58956        2.00214
  S       -2.75882        0.94962        1.83612
  S       16.40911       -6.03988        2.53558
  H       -1.46741       18.82786        2.67906
  C        5.82664        5.94270        2.01452
  C        5.26947      -23.06701        3.18066
  N       -8.84939       11.86928        2.37886
  S       -6.55654        1.92399        1.97368
  C       -3.71938      -10.09808        2.15236
  H       -9.83337        5.36900        2.18883
  C       -8.38863        3.99472        2.10693
  H        3.80486       -6.52890        2.03972
  F        3.54253       -0.97960        1.95383
  C        6.33375      -25.95321        3.62286
  C       -9.69065        4.45073        2.23277
  C       -8.16636        2.63810        2.14279
  C       -4.93349        8.41978        2.26981
  C       -1.37198       -2.83660        2.07661
  N      -19.57533        6.78080        3.09973
  C       -9.23367        1.80955        2.29906
  C       12.52871        4.57211        2.52039
  N      -10.74007        3.66721        2.40951
  C       27.90435       -3.54940        3.98667
  H       -9.10971        0.88934        2.33085
  H        2.39750       -4.75600        2.20166
  C      -10.49524        2.33201        2.41088
  N      -16.27559       -5.88711        2.84514
  F        8.59613        8.58026        2.48837
  C       -5.77152        9.49893        2.43304
  C       -5.51520        3.31214        2.24223
  C       17.06732       -1.46059        2.84636
  C      -18.47597        6.03258        3.04741
  H      -17.88865       -4.80174        2.96569
  C        4.43145      -21.98786        3.34389
  C       -6.08585      -14.59871        2.75119
  C       -0.95720      -20.22289        3.14173
  H        2.78969        4.98883        2.25587
  H      -11.21278        1.74895        2.48909
  O       -2.76658       -7.00981        2.32225
  F       15.10901       -8.71704        2.91235
  C       20.07700       -7.75154        3.28786
 Cl       -3.86066      -11.82868        2.59492
  N        5.32710      -18.16079        3.08602
  C       28.70069       -2.46462        4.20455
  O      -13.58411        2.31018        2.70902
  C       -0.09008        1.57193        2.26922
  O        1.54411       11.37280        2.57871
  H       -8.64594      -12.84686        2.83569
  H       11.09396       11.20317        2.85835
  F      -22.95143       -4.91607        3.57502
  F       -1.81705       12.10984        2.63781
  F        4.60805      -14.69142        2.85834
  S      -11.65881       -1.63719        2.62829
  H       16.31284       -0.92068        2.93393
  C       -1.49340       -1.48083        2.33111
  F        5.11867        1.11841        2.38657
  C       -9.92633       11.27389        2.86064
  S        7.44763      -24.60980        3.89446
  O      -11.70762        6.70885        2.76903
  H       -9.05686       14.65443        3.04384
  C       -9.53352       -8.76993        2.74171
  N        6.90212      -10.15207        2.70995
  C       10.33949       11.74307        2.94592
 Cl        7.26866       -2.58098        2.51221
  O      -15.59734        1.64300        2.95727
  N        1.35358      -19.61751        3.28971
  F        2.15204        2.14730        2.41785
  C      -10.63603       -7.96684        2.81624
 Cl       -4.90811      -11.05358        2.76162
  C        4.72574        5.34370        2.54299
 Cl       -6.72850       -5.85710        2.68666
  H       -0.71024       -3.31055        2.52771
  H       -1.69084      -20.64168        3.53197
  C        8.14976       13.29369        3.09955
  C      -14.40243       -1.74776        3.02495
  C       21.06162       -8.59780        3.75291
  N      -14.75727        2.50908        3.09734
  C       -7.97132      -13.40883        3.14407
  H        7.39411       13.83009        3.16585
 Cl       -5.48972       -4.36842        2.70412
  F       -0.29278       14.20229        3.07610
  C       -3.86922        5.53358        2.71201
  C        3.94040       -5.91415        2.72390
 Cd      -12.77530        4.54132        3.05910
  C        8.04785      -12.21439        3.14586
  F      -16.68370       -2.05562        3.31008
  O       12.87010       -2.47409        3.07710
  C       14.87810        5.71037        3.27189
  C        6.28499      -23.27553        4.07021
  S        7.33834        5.89910        2.93263
  C        3.08846       -4.86184        2.81792
  C       -1.40123        1.52291        2.79215
  C        0.27663      -20.21290        3.77148
 Cl       -6.55962       -6.80067        3.03805
  H       19.41201       -7.44117        3.85827
  S       -2.75533        6.87699        2.98362
  O       14.35563        0.59340        3.37491
  N      -12.58641        7.34986        3.40280
  C      -24.29161       -6.63918        4.40797
  C        7.84275      -10.85401        3.33654
  C       -8.50604       15.10202        3.64419
  H       -0.93524       -1.06114        2.94448
  C        0.92374        2.14171        2.97199
  C       -3.91798        8.21127        3.15936
  O      -12.52137        8.56354        3.51016
  C      -13.17071       -1.15595        3.38215
  F       16.02041        6.30363        3.67064
  O       -4.77522       13.28072        3.45074
  O       -1.11077       -5.86153        3.07104
  H        9.18989       -6.58310        3.30516
  C       -8.71115       16.46240        3.83487
  N       18.91203       -2.53279        3.88100
  S       26.29935       -5.62756        4.73879
 Cd        6.32925       -7.96626        3.27473
  H        8.73555      -12.65893        3.58990
  O      -15.01892        3.65462        3.60582
  C       15.16528       -6.49531        3.70381
 Cl        7.40560       -3.30622        3.21761
  O       11.85808       -4.31553        3.47057
  N       -5.62336       10.36586        3.42621
  C       14.68124       -7.78110        3.77213
  C      -15.54139       -1.46236        3.70884
  C       12.50742        5.40396        3.59858
  H       -9.85318       10.83111        3.67557
  N       -2.03187       -6.66619        3.28503
  C       17.81268       -1.78457        3.93331
  C        3.77849       -0.60471        3.21952
  C       27.34069       -4.23941        5.00734
  N       11.92312       -3.10185        3.57793
  C      -19.92034        7.25921        4.28800
  N        4.57960      -21.12093        4.33706
 Cd       -6.99254       12.21427        3.70600
  H       25.17515       -2.96199        4.76724
  H        4.77861        4.90933        3.36256
  C      -23.49156       -5.55233        4.63851
  H        1.14611      -16.83236        3.95469
  O        4.11192       -9.03271        3.52999
  O      -13.53339        6.72210        3.90363
  C        4.57854        0.48214        3.45005
  C       24.68953       -4.91344        4.90790
  N       14.09399        1.73893        3.88338
  N        4.96007       -6.11784        3.55451
  N        1.36858       10.91420        3.69570
  C       24.46727       -3.55682        4.87204
  C       13.73914        5.99577        3.95578
  C       -5.24183        3.76587        3.53067
  H       -8.05741       -9.58208        3.81487
  C       -6.01699      -15.02797        4.07031
  O       14.93405        2.60501        4.02346
  C       -8.81305       -9.04568        3.88118
  O        5.42775      -18.20607        4.36159
 Cl       -4.53836       -4.48682        3.60225
  H        8.39357      -10.40642        3.93689
  O      -15.20000       -8.50856        4.26555
  H       -5.44190       -0.66132        3.61817
  H        0.34978      -20.65568        4.58641
 Cd       12.11200       -0.29331        3.92163
  C        9.97274       12.21485        4.16448
  C      -11.00278       -7.49506        4.03481
  N       -7.56541       14.40008        4.27077
  H       23.74619       -6.66220        5.09596
  C        8.87022       13.01794        4.23902
  C       -4.44178        4.85272        3.76121
  C       23.62223       -5.74199        5.06417
  O        0.44748       10.10954        3.90968
  F       -0.37052       -9.95428        3.90463
  H      -11.75725       -6.95516        4.12238
  H       23.02252       -2.18255        4.95394
  C       23.16525       -3.10082        4.99788
 Cd        3.21042      -19.27252        4.61685
  F       18.41770      -10.13382        4.76178
  H       -5.31528      -15.56830        4.35904
  C        3.25468       -3.96325        3.82137
  O      -16.21202      -10.35000        4.65902
  C        6.45121      -22.37695        5.07366
  H        0.80412      -14.57985        4.30167
  C        9.26304       -7.02588        4.12009
  O       12.92082        1.93783        4.27170
  C       -7.99310      -13.78601        4.47631
  C       -5.71055       -5.55536        4.02820
  S       -8.00163       -1.65109        4.04810
  O       11.04433       -2.46083        4.21170
  C        1.69692      -16.38477        4.55504
  C       22.36065       -5.21953        5.17599
  C       -3.75175        9.10984        4.16281
  N      -16.14698       -9.13632        4.76638
  H       11.23052       -6.59710        4.35960
  C       -4.60369       10.16216        4.25683
  H        0.27195        5.30915        4.03625
  S        2.09204       -2.62898        3.99711
  N       22.11583       -3.88433        5.17462
  S       10.99552        5.88520        4.35243
  C       -1.58703        2.10630        4.00873
  F       15.11305       -4.32682        4.58824
  C        5.59928      -21.32463        5.16767
  H       17.54051       -1.46561        4.76313
  C       14.68142       -5.58972        4.62387
  O      -13.71447       -5.44108        4.56336
  C      -13.19200       -0.32410        4.46034
  H       21.64311       -5.80260        5.25420
  S       21.19708       -9.18873        5.39340
  C       13.77348       -8.13186        4.73515
  F       13.32692       -9.40757        4.76179
  C        0.73794        2.72510        4.18858
  F        1.15376       -7.86183        4.34292
  C        1.49182      -15.02439        4.74572
  C      -15.56268       -0.63051        4.78703
  H       10.54949        2.49906        4.49164
  C        3.20593       -1.28557        4.26872
  F       -9.25943       -4.33225        4.49236
  O       -2.20740       -7.12479        4.40201
  N        8.18609       -7.62127        4.60187
  C       -7.00848      -14.63227        4.94136
  H        0.04695        7.55856        4.45302
  N       10.07677        0.58080        4.57122
  C        9.83195        1.91600        4.56984
  O        2.10329       11.25782        4.65848
  H        7.14217      -22.48278        5.68991
  C       -5.38903       -1.09568        4.43774
  C       10.49687       -7.01589        4.74985
 Cd      -15.95810       -6.32778        5.11008
  C        5.10823       -5.25092        4.54769
  F       13.77491        6.83028        4.98406
  H       -8.65808      -13.47564        5.04672
  C       27.61407       -3.78568        6.29578
  H        8.60730       13.37848        5.05471
  H        8.44642        3.35867        4.64988
  H       14.65209       -1.83793        4.98271
  O       21.14827       -0.84270        5.53414
  C       -6.78915       15.06418        5.11932
  N        2.63756      -17.08670        5.18162
  F       -5.78196        3.12961        4.59415
  C        8.57038        2.43846        4.68167
  F      -12.04969        0.26916        4.85910
  O       19.27178       -5.24137        5.47413
  F       -2.81533        2.10071        4.56287
  O      -17.02576       -8.49531        5.40015
  C        9.02736       -0.20272        4.74795
  N      -13.97611       -4.29554        5.07183
  H       -3.06079        9.00401        4.77906
  N        4.21257       -9.07798        4.80556
  C        0.83010        5.72884        4.64961
  C      -23.21818       -5.09860        5.92694
  C       28.41412       -2.69882        6.52632
  H        9.17008       -1.12099        4.79190
  F        4.93163      -12.54736        5.03324
  H       -4.46815       10.77691        4.94101
  C       -6.91056       16.41995        5.37383
  C        4.27020       -4.17177        4.71092
  C      -14.33096       -0.03870        5.14423
  C        4.85191        0.93587        4.73849
  C       -0.57321        2.67609        4.71151
  N       -9.15806       -8.56726        5.06945
  H       -3.45298       -0.74081        4.72485
  C        7.50307        1.60991        4.83793
  C      -10.25742       -7.81904        5.12177
  C        7.72534        0.25329        4.87380
  H        5.73482      -20.70988        5.85186
  H       -1.61231       11.37187        5.08243
  C       18.45346       -9.29931        5.79006
  O      -13.13605       -3.42946        5.21191
  C        0.70869        7.08461        4.90412
  H       -3.01966       13.14478        5.24438
 Cd       20.08060       -3.01023        5.82421
  S      -17.07458       -0.14927        5.54089
  C       -6.48993       -1.69469        4.96621
  H        7.01745       -0.34155        4.97859
  O      -15.14928       -4.09664        5.46015
  H      -10.84474        3.01528        5.20349
  H      -19.62368       -2.67580        5.83833
  S        5.89325        2.32402        5.00705
  N      -12.45779        4.10065        5.32404
  N      -17.99332       -5.45367        5.75967
  H      -17.52061       -3.53541        5.68009
  F       -4.20582        5.22761        5.02690
  O       -8.18375       10.89096        5.36496
  C      -18.23815       -4.11847        5.75830
  O       17.25856       -5.90855        5.72237
  C      -19.49972       -3.59601        5.87012
  S       10.99194       11.86090        5.57829
  C       -0.16575       -9.58387        5.17512
  C      -20.56702       -4.42456        6.02639
  H       -6.12741       14.59023        5.57042
  C      -19.04274       -6.23719        5.93641
  S      -22.17684       -3.71045        6.19550
  C      -20.34476       -5.78118        6.06225
  H        5.80339       -5.37397        5.15162
  H      -18.90002       -7.15546        5.98035
  H      -21.05264       -6.37602        6.16704
  N       18.09862       -5.04247        5.86245
  C       19.68518       -8.70750        6.14726
  C       13.77914       -5.95049        5.57996
  C       -9.17695       -2.12365        5.26415
  O        5.30555       -8.72891        5.30577
  C       -4.19868       -1.13144        5.11510
  F       -9.65240      -16.16829        5.95023
  C       -9.65663       -3.38752        5.35433
  C        2.32672      -14.35004        5.60974
  S        2.09553        3.29839        5.14461
  C       13.29946       -7.21436        5.67013
  C      -24.57818       -6.87339        6.72974
  N       20.26948       -0.20169        6.16790
  C        0.63059       -8.49909        5.39300
  F       16.17219       -9.60716        6.07519
  O        2.01922      -20.59583        6.27581
  C        1.79579        5.01203        5.32455
  O       20.33452        1.01199        6.27527
  O        3.29473       -9.41249        5.52742
  C       14.37992       -1.51897        5.81252
  H      -14.06310        5.05392        5.87840
  H        4.39510       -3.58910        5.42461
  C        3.41382      -16.42261        6.03017
  S        2.02698      -12.63640        5.78968
  O        0.82778        0.07448        5.40687
  C       -1.47677       11.98663        5.76661
  H       -0.27260       -5.74891        5.50968
  C       -2.32870       13.03894        5.86063
  N       13.28057       -0.77075        5.86484
  C      -11.50302        3.30206        5.79390
  H       12.78059        4.13764        5.88757
  C        8.32119       -8.20656        5.81919
  C        3.49192       -0.83892        5.54129
  C      -23.78184       -5.78861        6.94762
  F        9.69184        9.18374        5.95506
  H      -10.52959       -7.50008        5.95158
  F       27.07393       -4.42194        7.35926
  C       10.61243       -7.64332        5.96808
  C       17.31450       -9.01391        6.47395
  O       17.83697       -3.89693        6.37093
  H      -13.41800       -7.87240        6.17116
  S       -1.77075      -11.66203        5.92724
  N        1.48495        7.74870        5.75266
  O       -1.18305       -0.60910        5.62852
  C       11.13098        5.29426        5.99293
  O       -6.52794       12.03924        6.11375
  F      -14.29519        0.79581        6.17251
  C      -13.38849        4.49194        6.18678
  C        3.29240      -15.06685        6.28468
  C        4.28826        0.24586        5.75917
  H       -1.68088       -3.96404        5.78267
  H       -2.89495       -8.99646        5.95569
  H        4.07555      -16.89656        6.48127
  O       19.32250       -0.82944        6.66874
  C       -3.38057      -10.94792        6.09635
  C       -3.60283       -9.59129        6.06049
  C        4.69571      -12.01409        6.22278
  H       -4.32391      -12.69668        6.28441
  C       -4.44787      -11.77647        6.25262
  F       -0.80912        3.20935        5.90105
  N       -7.44904       11.23458        6.32774
  H        7.57549       -8.59719        6.20943
  S       -6.87302      -15.22320        6.58185
  H       -5.04757       -8.21702        6.14239
  C       -4.90485       -9.13529        6.18633
  C       -0.72941      -10.27388        6.19579
  F        6.93784      -11.43872        6.37141
  F       13.38193       -5.00576        6.44193
  F       -9.20441        0.06956        6.17250
  C       -9.65097       -1.20615        6.19913
  C       -5.70944      -11.25400        6.36444
  F      -10.99054       -5.01118        6.34604
  H        3.77272       11.31768        6.34787
  H       -6.42698      -11.83707        6.44265
  C      -10.55891       -3.74828        6.31042
  N       -5.95427       -9.91881        6.36307
  C       12.11561        4.44801        6.45797
  C       -6.37436       -2.32212        6.18444
 Cd        0.91208        9.93452        6.31744
  O        3.67502      -19.44755        7.02460
  C        2.63069        5.68638        6.18857
  C        9.51154       -8.24232        6.49655
  N       -0.09007       -0.26002        6.12873
  C       19.66390       -7.87564        7.22545
  C       -0.14769       -5.16624        6.22337
  O       -8.79831      -11.27584        6.66258
  C       -9.61663      -15.33378        6.97851
  H       15.87976       -2.38285        6.81190
  C        9.74812       11.40546        6.74652
  N        2.75393      -20.25221        7.23859
  C        2.42558        7.04676        6.37925
  N       -0.45709       11.78293        6.59723
  H        9.43779        6.23029        6.57525
  N       -4.06359       -1.71673        6.33242
  O      -10.81154      -11.94302        6.91083
  F      -11.89790      -15.64163        7.26364
  C       15.12528       -1.84295        6.89947
  C       -0.98572       -4.08708        6.38660
  H        3.85056      -14.64716        6.89804
  C        9.26407       10.11967        6.81484
  C        3.38457      -12.06310        6.74571
  O       -1.30524        8.86806        6.57270
  C       -2.16248       13.93752        6.86408
  S       12.12414       -7.68692        6.88619
  C      -13.69017       -7.55344        7.00097
  N      -14.78953       -6.80522        7.05329
  O        6.32991       -2.21322        6.53227
  H       -7.10801       -2.74091        6.57468
  F       20.80621       -7.28239        7.62420
  C      -16.93911       -0.74021        7.18138
  O       -6.92183       -6.87717        6.72259
  H      -15.28951       -1.89684        7.07602
  C        0.91658       -8.05244        6.66557
  N       -9.97148      -11.07694        7.05090
  C        5.70954      -11.44430        6.92555
  C       10.13950        5.68996        6.86398
  H        3.31839        5.24184        6.63262
  F        2.96875       -1.47618        6.59137
  C        9.83305       -3.78265        6.90609
  C       -8.38491      -14.74197        7.33571
  C       12.93555       -0.29233        7.05310
 Cd       -7.98950       -9.04470        7.01266
  C       17.29322       -8.18205        7.55214
  C       -5.14053       -2.31213        6.81420
  H       22.01115       -4.53627        7.96860
  H       12.17991        0.24407        7.11941
  C      -11.43416        2.87280        7.11302
  F      -23.57707       -5.41820        8.21811
  S        2.03047       -6.70902        6.93718
  H        2.97640        7.49435        6.97960
  C      -10.75559      -15.04838        7.66240
  C        3.84587       10.87489        7.16280
  C      -10.55873       -1.55691        7.16216
  H        9.56441       -8.67669        7.31612
  C      -11.04278       -2.84269        7.23048
  H      -18.63231        0.19582        7.76370
  C       18.52494       -7.59025        7.90934
  H       -4.27106        1.06841        6.99740
  F        9.69588       13.57395        7.63096
  F        4.49302        0.61627        7.02966
  H        5.81335       11.30368        7.40232
  O       -7.62457       10.77598        7.44473
  C      -15.95449       -1.58647        7.64642
  C        0.86782       -5.37475        7.11292
  C      -13.41027        4.11476        7.51903
  N       20.39810       -3.45090        8.08914
  O      -10.23313       -9.93140        7.55938
  C        9.26425       12.31105        7.66658
 Cl        8.66086       -4.85119        7.33204
  H      -10.73244        2.33247        7.40175
  N       -7.80061       -6.23616        7.35636
  C       -0.30894       12.64985        7.59040
  C       -0.45603       -9.82015        7.48423
  O       -7.73557       -5.02248        7.46372
  H       -4.61305        3.32093        7.34438
  C      -17.93060       -0.34451        8.05243
  C       -1.14697       13.72901        7.75363
  O        2.57840      -20.71081        8.35557
  N       -0.83757       -3.22016        7.37977
  N        2.76893       10.27950        7.64458
  C        8.35631        9.76892        7.77787
  C       12.09383        4.07082        7.79022
  O        0.01058       -0.30530        7.40430
  C       21.35288       -4.24949        8.55901
  C        5.07970       10.88488        7.79256
  H      -12.19033       -8.41732        8.00035
  C        0.34402       -8.73330        7.71477
  C      -12.94481       -7.87742        8.08793
  N        6.15438       -2.67181        7.64926
  H       -5.06738       -2.75491        7.62913
  O       -8.74760       -6.86392        7.85719
  C       -3.72024        1.51601        7.59775
  S       15.78132       -7.70082        8.30599
  H      -14.07525        4.42513        8.08943
  C      -12.42564        3.26851        7.98407
  C       14.75854       -1.37116        8.11804
  C      -15.13454       -6.32680        8.24156
 Cl       -3.28309       -6.03179        7.71668
 Cl       10.68213       -2.53734        7.89624
  H      -15.89018       -5.79040        8.30786
  C        3.19877      -11.47972        7.96230
 Cd       -2.20674       -1.37175        7.65956
  N       -1.20459        8.82279        7.84827
  H       12.76845        3.50885        8.09860
  F      -10.98650       -0.62097        8.02194
  C       -3.92535        2.87638        7.78843
  C       13.65602       -0.56808        8.19258
  H        5.05774       -8.27687        7.98981
  O        5.23328       -3.47647        7.86324
  H       18.79279       -2.49763        8.64351
  C       -8.40620      -13.91012        8.41390
  C        5.52373      -10.86092        8.14214
  H        0.38622       12.52680        8.19433
  C       10.20836        5.26071        8.18309
 Cl       10.85101       -3.48091        8.24763
 Cl        9.61222       -4.96959        8.23017
  H       -1.02206       14.31168        8.46732
  C      -10.77688      -14.21653        8.74059
  F       18.56071       -6.75574        8.93762
  F       -0.48554        5.35341        8.07595
  S      -12.28660       -3.29813        8.39871
  C       19.46741       -3.05960        8.95189
  C        1.03404       -4.47617        8.11637
  C        8.36197       11.95029        8.62267
  O       -0.11161        9.17186        8.34848
  C        0.18211       -3.42386        8.21039
  F        1.97046      -11.48530        8.51643
  N       -2.77961        0.81407        8.22433
  F       -7.26389      -13.31686        8.81265
  H        4.83275       -6.02746        8.40658
  F       -0.99616      -10.45641        8.54771
 Cl       -3.14616       -6.75703        8.42208
  N       11.16313        4.46212        8.65296
  C        4.21259      -10.90993        8.66507
  C      -15.97627       -1.96365        8.97867
  C        5.61590       -7.85718        8.60317
  O       -2.12244        8.48829        8.57013
  C       -9.54516      -13.62472        9.09779
  F      -15.06957        1.73249        8.99294
  H        9.55008        5.54749        8.77351
  O        6.88909       -2.32820        8.61204
  H       13.39310       -0.20754        9.00827
  C      -17.86174       -0.77376        9.37155
  C       -3.09045        3.55074        8.65245
  C        2.90402        9.69421        8.86190
  H       -9.90196       -4.81571        8.92229
  S      -12.28878      -13.73529        9.49444
  H        1.72500       -4.58201        8.73262
  C        5.49449       -6.50141        8.85768
  C        5.19527       10.25745        9.01079
  H      -15.30165       -2.52562        9.28705
  C       21.42173       -4.67874        9.87813
  S        6.88133      -10.28763        9.09817
  S       -3.39019        5.26438        8.83239
  C      -13.31156       -7.40564        9.30649
  C      -14.41407       -6.60255        9.38103
  H       -6.05894      -10.57074        9.15705
  F        0.57998       -8.35841        8.98046
  H       17.56639       -9.44838        9.84113
  H        0.31765       -2.80911        8.89457
  F        2.91116        3.33516        8.95010
  H       22.12345       -5.21907       10.16686
  N       -7.67200       -9.48537        9.27760
  S       15.77774       -1.72512        9.53185
  C        6.58158       -8.57399        9.27811
  H        3.17349       -2.21415        9.03599
  C       -4.35074       -5.78333        9.14863
  H        2.15832        9.30358        9.25214
  C       -2.00335        1.47816        9.07288
  H      -18.52002       -0.48698        9.96196
  N      -16.90696       -1.57235        9.84141
  C       15.91678       -8.29176        9.94649
  C       -0.72145        5.88668        9.26549
  H        1.76613       -0.44124        9.19794
  S      -12.29018        2.67757        9.62457
  C        4.09437        9.65845        9.53926
  O       -3.39795       -2.69505        9.31852
  C       -2.12476        2.83393        9.32739
  F        1.52068        6.46205        9.41413
  C       19.44563       -3.43678       10.28413
  F       14.47764       -4.40228        9.90862
  C       -6.71722      -10.28396        9.74746
 Cl       -4.49202       -7.51393        9.59119
  C      -10.16488       -4.45517        9.73798
  H       -9.27731       -8.53210        9.83196
  C      -15.03380        2.56699       10.02122
  C      -11.26740       -3.65209        9.81252
  F       -9.50939      -12.79021       10.12607
  C       16.90141       -9.13801       10.41153
  H       -1.34161        1.00421        9.52398
  N        6.27075       -5.83732        9.70622
  F        3.97668      -10.37667        9.85461
  F      -17.31507        2.25914       10.30636
 Cl       -5.53948       -6.73882        9.75789
  H      -14.67700       -6.24201       10.19672
  C       20.43025       -4.28304       10.74918
  C        3.30903       -1.59939        9.72017
  C       -2.03260        5.83767        9.78842
  O       12.23873        1.84066       10.07337
  C       -8.60269       -9.09408       10.14034
  C        2.45710       -0.54708        9.81419
  O       13.72426        4.90815       10.37118
  C        7.41649       -7.89964       10.14213
  C        0.29237        6.45647        9.96826
  C      -13.80208        3.15880       10.37842
  H       14.22358       -7.35573       10.52881
  H       -1.56661        3.25362        9.94075
  H       18.78064       -3.12642       10.85454
  C      -16.17276        2.85239       10.70511
  O       -1.74214       -1.54678       10.06732
  C        7.21138       -6.53926       10.33281
  H        4.14724        9.22408       10.35883
  H        8.55852       -2.26834       10.30143
  C       14.92530       -7.89605       10.81754
  C        3.14712        3.71004       10.21579
  O       11.22671       -0.00077       10.46684
 Cd        5.69788       -3.65150       10.27100
  C       14.53391       -2.18056       10.70008
  H      -10.50371      -15.48285       11.02958
  S      -12.29236       -7.75959       10.72030
  N       -2.66324       -2.35144       10.28130
  H        8.10419       -8.34418       10.58618
  C       14.04987       -3.46635       10.76840
  N       11.29175        1.21291       10.57420
  C      -12.15331      -14.32623       11.13494
  N       13.46262        6.05369       10.87965
  C        3.94717        4.79690       10.44633
  F      -13.59246      -10.43675       11.09707
  O       14.30268        6.91977       11.01973
  O        3.48056       -4.71796       10.52626
  N        4.32870       -1.80309       10.55079
 Cd       11.48063        4.02145       10.91790
  H       -8.68877       -5.26732       10.81115
  O      -15.83136       -4.19381       11.26182
  C       -9.44442       -4.73092       10.87745
  C      -11.63414       -3.18030       11.03108
  C       -6.64836      -10.71322       11.06658
  H        7.76220       -6.09167       10.93316
  H      -12.38862       -2.64040       11.11866
  C      -11.16869      -15.17248       11.59998
  C        2.62332        0.35150       10.81764
  O       12.28945        6.25259       11.26797
  H      -13.84651      -13.39020       11.71726
  C       16.87963       -9.51519       11.74378
  C       -2.21840        6.42105       11.00501
  F       17.78633       -5.81906       11.75805
  C        8.63167       -2.71112       11.11636
  O       10.41296        1.85392       11.20797
  C      -13.82337        3.99066       11.45661
  H       -5.94665      -11.25354       11.35531
  S        1.46067        1.68577       10.99338
  N      -16.77835       -4.82156       11.76266
  H       17.55424      -10.07717       12.05216
  O      -14.34583       -1.12632       11.55963
  C        0.10657        7.03985       11.18485
  H       10.59915       -2.28234       11.35588
  F       14.48168       -0.01207       11.58452
  C       -8.62447       -9.47126       11.47259
  C      -13.14480      -13.93053       12.00599
  C      -16.19404        3.68425       11.78330
  C       14.05005       -1.27497       11.62014
  H        9.91812        6.81382       11.48791
  C        2.57456        3.02919       11.26499
  C      -14.02022       -9.50082       11.95685
  C        9.20058        6.23075       11.56612
  C       13.14211       -3.81710       11.73143
  C      -13.53618       -8.21503       11.88853
  S       20.56571       -4.87398       12.38967
  N        9.44540        4.89556       11.56749
  F       12.69555       -5.09281       11.75806
  H        7.81505        7.67342       11.64615
  O       -2.83877       -2.81004       11.39829
  F      -12.68106        4.58391       11.85537
  C        7.93901        6.75321       11.67794
  C       14.99416       -8.32531       12.13665
 Cd      -16.58946       -2.01302       12.10635
  F       -3.44670        6.41547       11.55914
  N        7.55472       -3.30652       11.59814
  H       14.02072        2.47683       11.97898
  C        9.86550       -2.70113       11.74612
  C        4.47686       -0.93617       11.54396
  C        8.39599        4.11204       11.74423
  C       -7.63985      -10.31751       11.93763
  N      -14.60748        0.01922       12.06811
  C      -14.96233        4.27606       12.14050
  H        8.53871        3.19377       11.78817
  C       -1.20458        6.99084       11.70778
  O      -17.65713       -4.18055       12.39642
  H       -9.28945       -9.16089       12.04299
  C        6.87171        5.92467       11.83421
  C        3.63883        0.14299       11.70719
  C        7.09397        4.56804       11.87007
  N        3.58121       -4.76323       11.80183
  N       15.94893       -9.12390       12.60652
  N       -9.78943       -4.25250       12.06572
  C      -10.88879       -3.50428       12.11804
  H        6.38609        3.97321       11.97486
  O      -15.78065        0.21811       12.45643
  C      -18.86951        0.19628       12.75457
  N      -18.62469       -1.13892       12.75594
  C       17.82210       -4.98455       12.78633
  C      -19.67411       -1.92243       12.93268
  C      -11.19047      -15.54966       12.93223
  H       14.33588       -8.03853       12.72707
  H        5.17202       -1.05922       12.14789
  C      -14.92799       -9.85157       12.91988
  C       13.14777       -1.63573       12.57623
  C      -14.02005       -7.30944       12.80859
  C       19.05381       -4.39274       13.14353
  O        4.67419       -4.41416       12.30204
  F      -13.58842       -6.04654       12.77297
  C       12.66809       -2.89961       12.66640
  C       13.74856        2.79579       12.80879
  H      -10.51585      -16.11164       13.24061
  F      -10.28377      -11.85353       12.94650
  H        3.76374        0.72566       12.42088
  C      -13.07594      -14.35978       13.32510
  N       12.64920        3.54401       12.86111
  O        2.66336       -5.09773       12.52369
  C        2.86055        3.47584       12.53756
  F      -14.92656        5.11056       13.16878
  H      -11.16095       -3.18532       12.94785
  C        7.68982       -3.89181       12.81546
  C        3.65689        4.56062       12.75544
  C        9.98106       -3.32856       12.96435
  C       16.68314       -4.69916       13.47022
  F       -1.44049        7.52411       12.89732
  N      -12.12116      -15.15837       13.79497
  C       -4.23420       -5.27654       13.05676
  H      -13.73422      -14.07300       13.91552
  O       17.02453      -11.74535       14.02693
  H       -5.67894       -3.90227       13.13866
  F       12.75056       -0.69100       13.43820
  H        6.94412       -4.28244       13.20570
  C       -5.07924       -7.46171       13.24889
  C       -5.53622       -4.82053       13.18260
  C      -14.92233       -7.67020       13.76468
  C       -6.34081       -6.93925       13.36071
  S       -7.50438      -10.90845       13.57813
  N       -6.58564       -5.60405       13.35934
  H       -7.05835       -7.52232       13.43892
  H       15.24839        1.93191       13.80818
  C        8.88017       -3.92757       13.49282
  O       18.51006       -8.67787       14.32474
  C       19.03253       -3.56089       14.22172
  O       -9.42968       -6.96108       13.65886
  O       16.01251      -13.58679       14.42040
  C       14.49392        2.47181       13.89575
  C      -10.24800      -11.01902       13.97478
  O      -11.44291       -7.62826       13.90710
  N      -15.42089       -2.49046       14.04956
  C      -14.32154       -3.23868       13.99724
  N       16.07755      -12.37311       14.52776
  S       11.49277       -3.37216       13.88246
  F      -12.52927      -11.32688       14.25991
  F        2.33738        2.83858       13.58764
  O       -7.55319       -2.56242       13.71886
  F       20.17484       -2.96763       14.62048
  C       12.30419        4.02243       14.04938
  N      -10.60285       -6.76218       14.04718
  H       11.54854        4.55883       14.11569
 Cd       -8.62087       -4.72995       14.00893
  C       -9.01628      -10.42722       14.33198
  N       18.24841       -7.53233       14.83321
  O       19.08848       -6.66625       14.97329
 Cd       16.26643       -9.56457       14.87146
  C      -11.38696      -10.73363       14.65867
  H        8.93304       -4.36193       14.31239
  C       17.89357       -3.27549       14.90561
  O      -11.04557      -17.77983       15.21538
  N       -8.43198       -1.92141       14.35263
  O      -10.86449       -5.61665       14.55565
  O       15.19876      -11.73210       15.16153
  O      -12.05759      -19.62126       15.60885
  O       -8.36694       -0.70772       14.45999
  O       17.07525       -7.33343       15.22154
  N      -11.99255      -18.40758       15.71622
  C       14.12717        2.94359       15.11431
  C      -15.76591       -2.01205       15.23783
  O       -9.37896       -2.54916       14.85346
  C       13.02465        3.74668       15.18885
  H       18.80652      -11.10919       15.93254
  O       -9.56004      -14.71234       15.51319
  H       14.70392       -6.77220       15.44147
  N       14.23120       -8.69046       15.52105
  C       13.98638       -7.35527       15.51968
  C       -9.03757       -9.59536       15.41017
  H       13.32451      -10.39225       15.74173
  C       13.18179       -9.47398       15.69778
 Cd      -11.80367      -15.59904       16.05991
  C       12.72481       -6.83280       15.63150
  H       12.60085       -5.91259       15.59971
  O      -12.87133      -17.76657       16.34998
  C      -11.40825       -9.90177       15.73686
  C       11.87977       -9.01797       15.82363
  C       11.65750       -7.66135       15.78777
  N       -9.82168      -13.56680       16.02167
  H       11.17188       -9.61281       15.92842
  F       -7.89526       -9.00211       15.80893
  H       12.76173        4.10721       16.00454
  O       -8.98162      -12.70072       16.16174
  S       10.04768       -6.94724       15.95688
  C       18.53436      -10.79023       16.76235
  C      -10.17653       -9.30996       16.09406
  O      -10.99485      -13.36790       16.40999
  N      -13.83889      -14.72493       16.70950
  H      -14.74559      -16.42672       16.93018
  C      -14.88831      -15.50845       16.88623
  C      -14.08372      -13.38974       16.70813
  H      -13.36618      -12.80667       16.62992
  C      -16.19033      -15.05245       17.01208
  N       17.43500      -10.04201       16.81467
  C      -15.34529      -12.86728       16.81995
  S      -12.92015       -9.42054       16.49072
  H       -6.69031       -6.25599       16.15332
  N       -8.30336       -5.17062       16.27387
  H       -9.26357      -17.14366       17.12099
  H       20.03419      -11.65411       17.76174
  C       -7.34859       -5.96921       16.74374
  H       -9.90867       -4.21735       16.82824
  C       19.27971      -11.11421       17.84931
  F      -10.14076       -8.47545       17.12234
  C       -9.23406       -4.77932       17.13661
  C       -9.53574      -16.82470       17.95080
  C       17.08998       -9.56359       18.00294
  N      -10.63510      -16.07648       18.00312
  H       16.33434       -9.02719       18.06924
  H      -11.13508      -11.16810       18.02585
  C      -12.78468      -10.01148       18.13121
  C       -7.27973       -6.39846       18.06285
  C       18.91297      -10.64243       19.06787
  C      -11.80006      -10.85773       18.59626
  H      -14.47788       -9.07544       18.71353
  C       17.81045       -9.83934       19.14241
  C       -8.79038      -17.14869       19.03776
  C       -9.25584       -5.15650       18.46886
  C      -10.98011      -15.59807       19.19139
  C      -13.77617       -9.61577       19.00226
  H      -11.73575      -15.06166       19.25770
  H       17.54753       -9.47881       19.95810
  S       19.93217      -10.99639       20.48168
  C      -11.82184      -11.23491       19.92850
  C      -10.25964      -15.87381       20.33086
  C      -13.70731      -10.04503       20.32138
