0 mol 7 unq 0 iso 0 dist 6.72215 9.19844 10.5551 5.38502 9.60499 7.5706 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.72215 9.19844 10.5551 7.39982 10.6581 6.28925 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 6.72215 9.19844 10.5551 17.8838 18.3807 8.70159 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.59893 6.95846 8.17454 11.9881 9.5589 7.56581 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 6.59893 6.95846 8.17454 10.3564 6.83299 9.22021 numMergedOcc 0
5 mol 54 unq 2 iso 0 dist 9.06005 6.95846 5.71377 11.9881 11.5304 7.56581 numMergedOcc 0
6 mol 54 unq 3 iso 0 dist 9.06005 6.95846 5.71377 10.3564 13.4839 9.22021 numMergedOcc 0
7 mol 59 unq 0 iso 0 dist 6.48625 8.91274 5.64744 6.34264 7.17396 8.49118 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 9.68526 8.91833 15.9091 8.31041 9.38498 9.33919 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 9.68526 8.91833 15.9091 5.44275 10.2049 9.79143 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 9.68526 8.91833 15.9091 11.2674 20.257 6.43377 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 7.26679 8.91833 7.9151 8.31041 9.96396 9.33919 numMergedOcc 0
12 mol 73 unq 4 iso 0 dist 7.26679 8.91833 7.9151 5.44275 6.19304 9.79143 numMergedOcc 0
13 mol 73 unq 5 iso 0 dist 7.26679 8.91833 7.9151 11.2674 8.70481 6.43377 numMergedOcc 0
14 mol 73 unq 6 iso 0 dist 9.30776 8.91833 5.44172 8.31041 9.75218 9.33919 numMergedOcc 0
15 mol 73 unq 7 iso 0 dist 9.30776 8.91833 5.44172 5.44275 11.6369 9.79143 numMergedOcc 0
16 mol 73 unq 8 iso 0 dist 9.30776 8.91833 5.44172 11.2674 10.1207 6.43377 numMergedOcc 0
17 mol 110 unq 0 iso 0 dist 7.21229 4.9088 6.13592 9.01856 14.5056 8.76445 numMergedOcc 0
18 mol 110 unq 1 iso 0 dist 5.25492 4.9088 7.3648 9.01856 14.1413 8.76445 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 8.53368 8.82502 9.30438 6.83988 13.4378 9.70093 numMergedOcc 0
20 mol 119 unq 1 iso 0 dist 8.53368 8.82502 9.30438 12.1168 15.7043 6.69217 numMergedOcc 0
21 mol 127 unq 0 iso 0 dist 8.40046 6.99723 10.7123 9.75166 9.30299 5.72373 numMergedOcc 0
22 mol 127 unq 1 iso 0 dist 8.40046 6.99723 10.7123 12.9471 14.7391 7.20988 numMergedOcc 0
23 mol 175 unq 0 iso 0 dist 9.00898 7.59434 5.32538 5.96451 9.29945 6.95549 numMergedOcc 0
24 mol 194 unq 0 iso 0 dist 9.48439 8.65631 12.3879 12.8467 15.834 7.61316 numMergedOcc 0
25 mol 219 unq 0 iso 0 dist 9.77442 7.44159 8.51365 11.5979 11.1317 5.40597 numMergedOcc 0
26 mol 219 unq 1 iso 0 dist 9.77442 7.44159 8.51365 14.2005 15.4022 7.66784 numMergedOcc 0
27 mol 219 unq 2 iso 0 dist 9.77442 7.44159 8.51365 10.1098 13.9267 8.69579 numMergedOcc 0
28 mol 219 unq 3 iso 0 dist 9.77442 7.44159 8.51365 5.49378 13.0405 6.71733 numMergedOcc 0
29 mol 234 unq 0 iso 0 dist 5.89084 9.71144 8.83842 4.74041 6.56247 7.72403 numMergedOcc 0
30 mol 234 unq 1 iso 0 dist 5.89084 9.71144 8.83842 6.16697 9.45496 6.35438 numMergedOcc 0
31 mol 234 unq 2 iso 0 dist 5.89084 9.71144 8.83842 16.1011 17.458 9.57132 numMergedOcc 0
32 mol 234 unq 3 iso 0 dist 8.47009 9.71144 5.43327 4.74041 9.36357 7.72403 numMergedOcc 0
33 mol 234 unq 4 iso 0 dist 8.47009 9.71144 5.43327 6.16697 6.7625 6.35438 numMergedOcc 0
34 mol 234 unq 5 iso 0 dist 8.47009 9.71144 5.43327 16.1011 10.701 9.57132 numMergedOcc 0
35 mol 239 unq 0 iso 0 dist 6.37342 7.84904 4.86449 5.29737 6.16342 5.45139 numMergedOcc 0
36 mol 239 unq 1 iso 0 dist 6.37342 7.84904 4.86449 15.9383 11.8467 8.10769 numMergedOcc 0
37 mol 273 unq 0 iso 0 dist 7.89852 7.14243 7.29345 7.52275 13.4294 9.82018 numMergedOcc 0
38 mol 277 unq 0 iso 0 dist 8.57532 9.25134 4.92923 12.4605 12.1282 9.78482 numMergedOcc 0
39 mol 277 unq 1 iso 0 dist 9.02914 9.25134 13.5647 12.4605 16.3787 9.78482 numMergedOcc 0
40 mol 277 unq 2 iso 0 dist 6.90434 9.25134 14.8109 12.4605 14.8559 9.78482 numMergedOcc 0
