0 mol 7 unq 0 iso 0 dist 8.41173 6.22892 6.3027 5.13744 10.2446 6.36911 14.5008 17.1684 13.2247 9.36807 numMergedOcc 0
1 mol 16 unq 0 iso 0 dist 9.31149 8.17898 7.59626 12.0005 14.2613 7.03948 10.6491 11.7457 6.92781 5.47769 numMergedOcc 0
2 mol 16 unq 1 iso 0 dist 9.31149 8.17898 7.59626 12.0005 14.2613 7.03948 15.8595 15.9291 10.7015 6.58035 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 9.3147 7.84393 10.5285 6.31174 14.6162 8.73972 10.1953 13.4414 5.03957 8.23643 numMergedOcc 0
4 mol 19 unq 1 iso 0 dist 9.79426 7.84393 9.84922 6.31174 9.04865 8.73972 10.1953 12.4435 5.03957 8.23643 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 9.3473 9.10915 9.82646 12.9814 17.231 8.68586 19.0957 18.8642 10.6748 9.54144 numMergedOcc 0
6 mol 64 unq 1 iso 0 dist 8.14932 8.66921 9.82646 11.75 17.231 8.68586 16.3435 18.8642 10.6748 9.54144 numMergedOcc 0
7 mol 64 unq 2 iso 0 dist 6.17846 8.66921 5.33496 11.75 9.82635 8.68586 16.3435 10.8691 10.6748 9.54144 numMergedOcc 0
8 mol 64 unq 3 iso 0 dist 6.08228 5.54343 5.33496 5.68492 9.82635 8.68586 12.0432 10.8691 10.6748 9.54144 numMergedOcc 0
9 mol 64 unq 4 iso 0 dist 9.86958 9.99634 10.8691 11.6323 9.82635 9.54144 13.7301 5.33496 10.6748 8.68586 numMergedOcc 0
10 mol 73 unq 0 iso 0 dist 5.39171 4.24428 8.04817 5.14919 6.4154 5.64598 10.392 10.4716 7.4697 8.70133 numMergedOcc 0
11 mol 73 unq 1 iso 0 dist 5.39171 4.24428 8.04817 5.14919 6.4154 5.64598 6.30194 5.2774 5.7113 4.65521 numMergedOcc 0
12 mol 73 unq 2 iso 0 dist 5.39171 6.30194 5.2774 5.14919 6.4154 4.65521 10.392 10.4716 5.4148 8.70133 numMergedOcc 0
13 mol 73 unq 3 iso 0 dist 5.39171 6.30194 5.2774 5.14919 6.4154 4.65521 4.24428 8.04817 5.7113 5.64598 numMergedOcc 0
14 mol 73 unq 4 iso 0 dist 9.27355 4.24428 9.76331 5.14919 9.51458 5.64598 10.392 8.31041 7.4697 8.70133 numMergedOcc 0
15 mol 73 unq 5 iso 0 dist 9.27355 4.24428 9.76331 5.14919 9.51458 5.64598 6.30194 5.44275 5.7113 4.65521 numMergedOcc 0
16 mol 73 unq 6 iso 0 dist 9.27355 6.30194 5.44275 5.14919 9.51458 4.65521 10.392 8.31041 5.4148 8.70133 numMergedOcc 0
17 mol 73 unq 7 iso 0 dist 9.27355 6.30194 5.44275 5.14919 9.51458 4.65521 4.24428 9.76331 5.7113 5.64598 numMergedOcc 0
18 mol 73 unq 8 iso 0 dist 8.60363 4.24428 10.4402 5.14919 10.9127 5.64598 10.392 11.7069 7.4697 8.70133 numMergedOcc 0
19 mol 73 unq 9 iso 0 dist 8.60363 4.24428 10.4402 5.14919 10.9127 5.64598 6.30194 8.0624 5.7113 4.65521 numMergedOcc 0
20 mol 73 unq 10 iso 0 dist 8.60363 6.30194 8.0624 5.14919 10.9127 4.65521 10.392 11.7069 5.4148 8.70133 numMergedOcc 0
21 mol 73 unq 11 iso 0 dist 8.60363 6.30194 8.0624 5.14919 10.9127 4.65521 4.24428 10.4402 5.7113 5.64598 numMergedOcc 0
22 mol 87 unq 0 iso 0 dist 9.10245 5.26938 5.39287 7.62644 12.6881 7.51358 8.91602 11.6194 7.40574 8.32298 numMergedOcc 0
23 mol 87 unq 1 iso 0 dist 9.10245 8.91602 11.6194 7.62644 12.6881 8.32298 5.26938 5.39287 7.40574 7.51358 numMergedOcc 0
24 mol 119 unq 0 iso 0 dist 8.24549 6.85677 5.19198 11.7378 12.9568 8.43904 14.3566 13.9326 9.22558 6.19042 numMergedOcc 0
25 mol 130 unq 0 iso 0 dist 7.9663 9.05626 9.97628 5.53247 10.7605 6.89257 10.2152 10.1517 6.83397 6.79146 numMergedOcc 0
26 mol 130 unq 1 iso 0 dist 7.9663 9.05626 9.97628 5.53247 10.7605 6.89257 12.8824 15.6841 7.50049 7.66168 numMergedOcc 0
27 mol 130 unq 2 iso 0 dist 7.9663 9.05626 9.97628 8.63186 15.0759 8.74308 12.8824 15.6841 7.50049 9.12581 numMergedOcc 0
28 mol 140 unq 0 iso 0 dist 9.92335 9.41832 8.78908 6.92517 11.5599 6.95323 5.44596 4.83408 6.43459 7.27371 numMergedOcc 0
29 mol 140 unq 1 iso 0 dist 9.92335 5.44596 4.83408 6.92517 11.5599 7.27371 9.41832 8.78908 6.43459 6.95323 numMergedOcc 0
30 mol 214 unq 0 iso 0 dist 9.81136 8.47248 4.82712 15.9026 6.35728 8.60247 18.1374 10.644 10.3105 7.46831 numMergedOcc 0
31 mol 214 unq 1 iso 0 dist 7.25293 8.47248 7.84001 15.9026 14.4364 8.60247 18.1374 13.8655 10.3105 7.46831 numMergedOcc 0
32 mol 218 unq 0 iso 0 dist 9.86417 9.88212 9.38348 12.7227 15.6702 7.17547 11.5094 12.0496 7.83217 7.13323 numMergedOcc 0
33 mol 224 unq 0 iso 0 dist 7.62593 4.79841 5.41021 7.32238 6.4508 6.67585 9.04374 4.91322 4.70378 6.65984 numMergedOcc 0
34 mol 238 unq 0 iso 0 dist 6.74214 8.89538 10.4952 13.2905 14.0108 6.77463 13.8505 15.4992 5.31152 8.14172 numMergedOcc 0
35 mol 238 unq 1 iso 0 dist 6.74214 8.89538 10.4952 10.4286 15.4111 7.2766 15.5527 19.1108 8.87326 6.05141 numMergedOcc 0
36 mol 238 unq 2 iso 0 dist 6.74214 8.89538 10.4952 10.4286 15.4111 7.2766 13.8505 15.4992 5.31152 8.09066 numMergedOcc 0
37 mol 238 unq 3 iso 0 dist 5.33462 8.89538 7.22173 13.2905 9.75691 6.77463 13.8505 12.4843 5.31152 8.14172 numMergedOcc 0
38 mol 238 unq 4 iso 0 dist 5.33462 8.89538 7.22173 10.4286 11.8665 7.2766 15.5527 15.5022 8.87326 6.05141 numMergedOcc 0
39 mol 238 unq 5 iso 0 dist 5.33462 8.89538 7.22173 10.4286 11.8665 7.2766 13.8505 12.4843 5.31152 8.09066 numMergedOcc 0
40 mol 272 unq 0 iso 0 dist 7.50321 4.78812 5.96981 6.99865 12.5113 6.73206 6.62923 7.55961 5.40809 9.09992 numMergedOcc 0
41 mol 272 unq 1 iso 0 dist 7.50321 6.62923 7.55961 6.99865 12.5113 9.09992 4.78812 5.96981 5.40809 6.73206 numMergedOcc 0
42 mol 272 unq 2 iso 0 dist 9.61597 4.78812 6.76845 6.99865 12.8442 6.73206 6.62923 5.43733 5.40809 9.09992 numMergedOcc 0
43 mol 272 unq 3 iso 0 dist 9.61597 6.62923 5.43733 6.99865 12.8442 9.09992 4.78812 6.76845 5.40809 6.73206 numMergedOcc 0
44 mol 276 unq 0 iso 0 dist 8.14494 5.30976 9.95911 10.4141 17.9035 8.76347 10.7112 16.3576 8.88126 9.38971 numMergedOcc 0
45 mol 276 unq 1 iso 0 dist 8.14494 5.30976 9.95911 10.4141 17.9035 8.76347 10.6561 14.7283 5.50479 8.71541 numMergedOcc 0
46 mol 282 unq 0 iso 0 dist 7.93511 9.51581 5.04235 10.8603 10.0733 7.32347 14.1723 9.63727 5.39891 6.85028 numMergedOcc 0
47 mol 282 unq 1 iso 0 dist 7.93511 9.51581 5.04235 10.8603 10.0733 7.32347 16.4085 15.3559 10.5372 8.3411 numMergedOcc 0
48 mol 282 unq 2 iso 0 dist 5.62497 8.58671 4.85461 4.91806 5.2527 6.85028 11.0247 8.85797 5.39891 7.32347 numMergedOcc 0
49 mol 282 unq 3 iso 0 dist 5.62497 8.58671 4.85461 4.91806 5.2527 6.85028 10.3918 5.43514 7.76539 8.3411 numMergedOcc 0
