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Text File | 1993-05-12 | 9.7 KB | 394 lines | [TEXT/MOLE] |
- ; Stick colour
- 2(0.700000, 0.700000, 0.700000)
- ; Model
- BS
- ; Definitions
- C = 8.768404, 3.507362(0.500000, 0.500000, 0.500000)
- ; Instances
- C2 : -108.406701 -44.176802 -38.055022
- C10 : -128.827437 -49.438927 -31.755933
- C16 : -134.730778 -46.617178 -53.085683
- C23 : -127.133774 -25.635013 -56.467424
- C31 : -110.982986 -20.668459 -71.136102
- C38 : -99.553820 -2.210569 -75.909349
- C47 : -81.742906 3.354330 -87.882265
- C54 : -62.568154 -2.770532 -78.490916
- C61 : -51.664773 16.182806 -83.928774
- C67 : -57.986763 36.381569 -92.256114
- C74 : -43.161178 51.955083 -98.658223
- C80 : -46.260285 72.986407 -105.685716
- C84 : -36.205028 92.824976 -105.021379
- C89 : -42.287379 109.807863 -91.806527
- C96 : -57.963791 123.562167 -99.198291
- C100 : -67.761239 105.695549 -107.876984
- C109 : -85.302273 92.770588 -102.653130
- C120 : -84.855570 70.504200 -99.867134
- C127 : -101.049537 55.351105 -97.205436
- C134 : -100.903526 38.174828 -83.003838
- C142 : -113.610713 21.211751 -90.259770
- C148 : -123.652410 7.413095 -75.609400
- C154 : -138.821675 -6.759352 -83.716515
- C161 : -152.243462 -18.402923 -70.204713
- C165 : -170.383450 -29.689833 -75.738640
- C171 : -192.505119 -32.089211 -72.834031
- C177 : -187.363193 -42.821491 -53.955700
- C183 : -177.512081 -24.453365 -45.891641
- C191 : -172.556105 -5.006056 -56.276986
- C199 : -189.174612 -3.437869 -71.164591
- C203 : -202.554838 -13.037252 -55.647639
- C208 : -210.089878 6.898691 -49.673646
- C212 : -194.455912 4.822949 -33.907364
- C220 : -179.349877 21.435073 -33.978034
- C230 : -157.609938 25.979553 -34.426265
- C237 : -143.174883 36.055295 -21.275379
- C246 : -121.795167 41.713651 -25.271623
- C260 : -102.996842 42.200835 -13.069924
- C272 : -82.758165 50.795734 -13.696737
- C281 : -64.477447 40.822396 -6.600699
- C290 : -43.528502 47.694980 -8.826553
- C298 : -25.069204 38.039598 -0.899532
- C305 : -25.954274 37.030974 21.244661
- C309 : -46.197269 38.859925 30.092842
- C316 : -66.826541 31.063429 27.562051
- C321 : -81.596690 36.190773 11.598015
- C328 : -91.834158 55.812779 10.858737
- C337 : -113.119571 57.091168 4.100221
- C345 : -113.075730 73.372155 -11.510255
- C353 : -130.651735 87.023289 -11.702219
- C361 : -139.008930 94.134883 -30.946809
- C372 : -149.970858 111.134175 -21.669377
- C382 : -141.388485 130.442871 -28.409823
- C390 : -123.851349 118.326666 -35.269287
- C398 : -119.083226 128.904557 -54.297878
- C403 : -103.972021 114.391179 -61.935214
- C414 : -113.210690 95.302337 -54.928132
- C425 : -132.496992 88.422768 -63.431787
- C431 : -144.898451 70.173742 -66.145153
- C438 : -156.843074 60.870112 -82.145720
- C444 : -167.806765 41.388721 -82.303277
- C453 : -179.371804 31.080399 -98.412207
- C459 : -188.798696 11.113064 -97.731295
- C463 : -173.682356 -1.575445 -86.983633
- C469 : -155.970725 11.258498 -90.482232
- C475 : -148.062897 26.920327 -77.062657
- C480 : -130.819647 40.194565 -82.500083
- C487 : -120.131723 57.545061 -73.075091
- C495 : -109.739997 75.096644 -81.435965
- C500 : -93.699774 85.422010 -70.242918
- C508 : -92.163548 103.559995 -82.801313
- C515 : -77.110329 119.493421 -82.724309
- C519 : -64.500005 103.009425 -75.553654
- C527 : -47.003095 108.405540 -63.285156
- C536 : -29.267471 97.423604 -55.558585
- C541 : -40.513723 98.563740 -36.685402
- C550 : -54.950762 83.513746 -44.560644
- C558 : -39.218262 67.853248 -45.724400
- C567 : -49.181434 51.470463 -34.337630
- C572 : -61.136069 32.545210 -35.995946
- C580 : -83.394682 33.522195 -37.314519
- C592 : -98.821151 18.772386 -32.455449
- C604 : -120.201150 17.352564 -37.926840
- C610 : -134.323074 8.551461 -23.958172
- C619 : -155.402872 2.292337 -27.058512
- C625 : -170.458189 -11.233524 -17.899331
- C637 : -179.736993 -31.222913 -20.436921
- C645 : -196.883512 -40.277329 -9.385232
- C656 : -187.915518 -30.246516 8.082940
- C662 : -166.759353 -35.730220 4.816328
- C670 : -151.666753 -19.578701 0.171175
- C681 : -140.138139 -26.502971 -17.787273
- C688 : -120.594076 -17.067019 -22.086034
- C699 : -111.778000 -10.381934 -41.013178
- C703 : -90.177553 -10.455524 -35.523533
- C707 : -75.626537 -2.362025 -50.415713
- C711 : -70.493193 15.424493 -62.724442
- C718 : -50.526780 24.985938 -59.422977
- C727 : -51.174347 46.089740 -66.166170
- C735 : -31.550131 51.978208 -74.314290
- C742 : -27.617447 73.287858 -79.283193
- C749 : -15.972937 76.502769 -98.037305
- C757 : -1.530920 93.357825 -100.352791
- C768 : 8.314996 92.161610 -80.693775
- C777 : 27.821584 101.810839 -77.199605
- C784 : 44.665187 87.514823 -76.369107
- C793 : 53.830015 88.381478 -56.242761
- C798 : 73.915815 80.125247 -51.207344
- C803 : 75.200864 67.925545 -32.423160
- C810 : 89.135358 74.674286 -16.415453
- C816 : 99.290538 56.999665 -6.616769
- C823 : 108.068106 56.458070 13.794441
- C830 : 121.004992 39.356520 19.099823
- C838 : 123.735598 35.846781 40.992218
- C849 : 140.732153 23.000015 48.283496
- C856 : 138.719042 6.921997 63.659703
- C863 : 136.917807 12.737315 85.137412
- C869 : 154.482239 11.561344 98.787556
- C875 : 143.854165 -6.557393 106.470443
- C884 : 129.131160 -17.751830 93.443500
- C893 : 148.796584 -25.903643 86.452011
- C901 : 154.483650 -26.875320 107.876984
- C910 : 142.871353 -45.423261 105.622413
- C915 : 149.997458 -56.650330 87.949540
- C923 : 140.563348 -44.980667 71.612869
- C932 : 138.631983 -25.404785 61.136952
- C937 : 122.536035 -15.657164 49.249578
- C944 : 126.503037 1.683445 35.885866
- C952 : 107.855479 12.817868 31.056158
- C959 : 103.951409 23.743050 11.887343
- C965 : 85.610551 36.331621 12.624067
- C973 : 78.409756 42.592050 -7.480923
- C981 : 62.053809 57.647328 -7.493658
- C987 : 51.617793 70.933999 -21.708884
- C995 : 52.047547 65.943244 -43.589784
- C1006 : 32.703005 66.933107 -54.150301
- C1018 : 37.566657 52.783927 -70.535523
- C1025 : 34.817510 35.679552 -56.483556
- C1029 : 50.314599 20.035921 -59.227462
- C1034 : 71.858498 22.733042 -55.879635
- C1041 : 88.716248 8.543658 -55.294472
- C1048 : 101.922659 6.885687 -37.620195
- C1055 : 121.506343 -3.935651 -36.639656
- C1060 : 138.381994 -5.613935 -22.258640
- C1074 : 160.203430 -8.016178 -25.749333
- C1083 : 179.582617 -12.164788 -15.139034
- C1088 : 190.403001 5.617458 -23.096365
- C1096 : 196.716390 -7.780372 -39.698199
- C1102 : 180.597753 -22.092999 -44.438894
- C1108 : 159.114477 -22.562856 -38.708856
- C1115 : 150.204661 -35.826523 -23.161767
- C1122 : 131.560079 -47.727565 -24.548564
- C1131 : 133.548547 -56.096682 -4.128544
- C1136 : 116.972280 -52.641555 9.802467
- C1140 : 107.669483 -37.627038 -3.471069
- C1147 : 86.654318 -33.335987 1.792410
- C1156 : 77.348178 -17.155978 -9.874409
- C1163 : 55.718488 -12.477149 -7.583854
- C1170 : 41.626314 -6.268027 -23.540033
- C1177 : 35.938973 15.375757 -23.333180
- C1184 : 16.279695 23.072983 -15.605714
- C1190 : 6.973695 43.132954 -18.719460
- C1199 : 6.636303 56.986614 -1.240611
- C1208 : 4.400867 78.810437 -2.720349
- C1214 : 1.128213 92.449158 -19.419792
- C1222 : -0.834705 73.578481 -30.952345
- C1230 : 20.518305 67.378138 -28.209526
- C1239 : 31.065486 48.044924 -24.805832
- C1251 : 45.173832 41.587914 -8.733606
- C1256 : 57.796086 23.079969 -8.361508
- C1261 : 73.203343 15.442837 5.921643
- C1267 : 90.343797 1.254683 2.818694
- C1273 : 99.426839 -11.962208 18.490492
- C1285 : 119.625454 -21.521328 18.341909
- C1293 : 124.703305 -37.121582 33.220409
- C1299 : 146.466541 -38.024325 38.359060
- C1307 : 159.339724 -50.431555 51.286377
- C1314 : 169.612543 -36.529759 65.121986
- C1321 : 189.519628 -44.239570 59.924378
- C1330 : 196.917701 -43.088949 39.443181
- C1339 : 178.133825 -39.029785 27.616565
- C1353 : 190.266319 -46.243772 10.486290
- C1362 : 199.306079 -27.429418 2.331663
- C1368 : 206.253948 -7.419070 8.713533
- C1378 : 204.767489 10.587752 20.618839
- C1387 : 188.723381 18.273974 7.559926
- C1393 : 167.276881 12.542287 3.929480
- C1405 : 153.075603 22.085903 -10.277273
- C1411 : 131.377751 20.449718 -14.635335
- C1417 : 128.331802 22.907035 -36.641198
- C1426 : 108.323699 30.760161 -42.460188
- C1433 : 102.247145 33.595532 -63.766151
- C1440 : 83.789456 43.986906 -70.091778
- ; Bonds
- C2, C10
- C10, C16
- C16, C23
- C23, C31
- C31, C38
- C38, C47
- C47, C54
- C54, C61
- C61, C67
- C67, C74
- C74, C80
- C80, C84
- C84, C89
- C89, C96
- C96, C100
- C100, C109
- C109, C120
- C120, C127
- C127, C134
- C134, C142
- C142, C148
- C148, C154
- C154, C161
- C161, C165
- C165, C171
- C171, C177
- C177, C183
- C183, C191
- C191, C199
- C199, C203
- C203, C208
- C208, C212
- C212, C220
- C220, C230
- C230, C237
- C237, C246
- C246, C260
- C260, C272
- C272, C281
- C281, C290
- C290, C298
- C298, C305
- C305, C309
- C309, C316
- C316, C321
- C321, C328
- C328, C337
- C337, C345
- C345, C353
- C353, C361
- C361, C372
- C372, C382
- C382, C390
- C390, C398
- C398, C403
- C403, C414
- C414, C425
- C425, C431
- C431, C438
- C438, C444
- C444, C453
- C453, C459
- C459, C463
- C463, C469
- C469, C475
- C475, C480
- C480, C487
- C487, C495
- C495, C500
- C500, C508
- C508, C515
- C515, C519
- C519, C527
- C527, C536
- C536, C541
- C541, C550
- C550, C558
- C558, C567
- C567, C572
- C572, C580
- C580, C592
- C592, C604
- C604, C610
- C610, C619
- C619, C625
- C625, C637
- C637, C645
- C645, C656
- C656, C662
- C662, C670
- C670, C681
- C681, C688
- C688, C699
- C699, C703
- C703, C707
- C707, C711
- C711, C718
- C718, C727
- C727, C735
- C735, C742
- C742, C749
- C749, C757
- C757, C768
- C768, C777
- C777, C784
- C784, C793
- C793, C798
- C798, C803
- C803, C810
- C810, C816
- C816, C823
- C823, C830
- C830, C838
- C838, C849
- C849, C856
- C856, C863
- C863, C869
- C869, C875
- C875, C884
- C884, C893
- C893, C901
- C901, C910
- C910, C915
- C915, C923
- C923, C932
- C932, C937
- C937, C944
- C944, C952
- C952, C959
- C959, C965
- C965, C973
- C973, C981
- C981, C987
- C987, C995
- C995, C1006
- C1006, C1018
- C1018, C1025
- C1025, C1029
- C1029, C1034
- C1034, C1041
- C1041, C1048
- C1048, C1055
- C1055, C1060
- C1060, C1074
- C1074, C1083
- C1083, C1088
- C1088, C1096
- C1096, C1102
- C1102, C1108
- C1108, C1115
- C1115, C1122
- C1122, C1131
- C1131, C1136
- C1136, C1140
- C1140, C1147
- C1147, C1156
- C1156, C1163
- C1163, C1170
- C1170, C1177
- C1177, C1184
- C1184, C1190
- C1190, C1199
- C1199, C1208
- C1208, C1214
- C1214, C1222
- C1222, C1230
- C1230, C1239
- C1239, C1251
- C1251, C1256
- C1256, C1261
- C1261, C1267
- C1267, C1273
- C1273, C1285
- C1285, C1293
- C1293, C1299
- C1299, C1307
- C1307, C1314
- C1314, C1321
- C1321, C1330
- C1330, C1339
- C1339, C1353
- C1353, C1362
- C1362, C1368
- C1368, C1378
- C1378, C1387
- C1387, C1393
- C1393, C1405
- C1405, C1411
- C1411, C1417
- C1417, C1426
- C1426, C1433
- C1433, C1440
-