0 mol 16 unq 0 iso 0 dist 8.17898 9.04834 10.2656 12.0005 7.03948 16.3417 10.6491 6.92781 16.4761 5.47769 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 8.17898 9.04834 10.2656 12.0005 7.03948 16.3417 15.8595 10.7015 20.903 6.58035 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 7.84393 7.78708 8.01051 6.31174 8.73972 12.3782 10.1953 5.03957 12.8837 8.23643 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 9.10915 7.02352 9.21892 12.9814 8.68586 15.6843 19.0957 10.6748 19.5452 9.54144 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 4.24428 6.30194 5.7113 5.14919 5.64598 4.65521 10.392 7.4697 5.4148 8.70133 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 6.30194 4.24428 5.7113 5.14919 4.65521 5.64598 10.392 5.4148 7.4697 8.70133 numMergedOcc 0
6 mol 87 unq 0 iso 0 dist 9.1329 9.33217 10.5639 11.1364 7.51358 16.6571 9.03114 7.40574 11.1798 8.32298 numMergedOcc 0
7 mol 87 unq 1 iso 0 dist 9.03114 9.33217 11.1798 11.1364 8.32298 16.6571 9.1329 7.40574 10.5639 7.51358 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 5.67862 7.97208 5.00817 6.30187 5.42582 8.6355 10.738 5.49782 8.80819 8.79571 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 7.97208 5.67862 5.00817 6.30187 8.6355 5.42582 10.738 8.80819 5.49782 8.79571 numMergedOcc 0
10 mol 140 unq 0 iso 0 dist 9.41832 9.69069 8.90548 6.92517 6.95323 12.3335 5.44596 6.43459 9.87462 7.27371 numMergedOcc 0
11 mol 140 unq 1 iso 0 dist 5.44596 9.69069 9.87462 6.92517 7.27371 12.3335 9.41832 6.43459 8.90548 6.95323 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 8.89538 7.98022 13.0839 13.2905 6.77463 14.1514 13.8505 5.31152 18.3161 8.14172 numMergedOcc 0
13 mol 238 unq 1 iso 0 dist 8.89538 7.98022 13.0839 10.4286 7.2766 16.5748 15.5527 8.87326 20.8397 6.05141 numMergedOcc 0
14 mol 238 unq 2 iso 0 dist 8.89538 7.98022 13.0839 10.4286 7.2766 16.5748 13.8505 5.31152 18.3161 8.09066 numMergedOcc 0
15 mol 276 unq 0 iso 0 dist 5.30976 8.28881 8.56707 10.4141 8.76347 12.4317 10.7112 8.88126 5.50132 9.38971 numMergedOcc 0
16 mol 276 unq 1 iso 0 dist 5.30976 8.28881 8.56707 10.4141 8.76347 12.4317 10.6561 5.50479 10.9991 8.71541 numMergedOcc 0
17 mol 282 unq 0 iso 0 dist 9.51581 6.84554 4.66602 10.8603 7.32347 10.4802 14.1723 5.39891 10.0156 6.85028 numMergedOcc 0
18 mol 282 unq 1 iso 0 dist 9.51581 6.84554 4.66602 10.8603 7.32347 10.4802 16.4085 10.5372 13.8266 8.3411 numMergedOcc 0
