0 mol 17 unq 0 iso 0 dist 8.84341 9.83585 7.93342 7.77965 7.02884 10.7623 6.20094 5.16502 10.8533 7.57677 numMergedOcc 0
1 mol 17 unq 1 iso 0 dist 8.84341 9.83585 7.93342 7.77965 7.02884 10.7623 8.77993 8.26398 14.0728 4.43871 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.53735 5.03531 6.36636 15.2626 9.34599 11.0698 12.9455 9.82851 10.2035 5.34406 numMergedOcc 0
3 mol 141 unq 0 iso 0 dist 6.49728 5.35509 3.80763 15.437 9.45931 12.9811 14.253 8.40695 10.3516 8.07317 numMergedOcc 0
4 mol 141 unq 1 iso 0 dist 6.49728 5.35509 3.80763 15.437 9.45931 12.9811 14.7502 9.35867 12.6128 5.69432 numMergedOcc 0
5 mol 158 unq 0 iso 0 dist 9.58371 4.80508 11.8112 7.26245 7.13199 11.6369 13.3796 9.45696 16.5348 10.7405 numMergedOcc 0
6 mol 158 unq 1 iso 0 dist 9.58371 4.88625 10.454 7.26245 7.13199 11.1342 13.3796 9.45696 13.9538 10.7405 numMergedOcc 0
7 mol 214 unq 0 iso 0 dist 9.84034 9.71467 4.05067 6.40387 8.07237 6.03628 10.2668 9.06389 10.8477 9.12568 numMergedOcc 0
8 mol 214 unq 1 iso 0 dist 9.84034 9.71467 4.05067 15.9216 8.95218 12.4799 10.2668 9.06389 10.8477 8.77167 numMergedOcc 0
9 mol 214 unq 2 iso 0 dist 8.07237 6.03628 4.05067 6.40387 9.84034 9.71467 9.12568 9.06389 10.8477 10.2668 numMergedOcc 0
10 mol 214 unq 3 iso 0 dist 8.07237 6.03628 4.05067 14.8373 8.95218 12.4799 9.12568 9.06389 10.8477 8.77167 numMergedOcc 0
11 mol 214 unq 4 iso 0 dist 8.95218 9.22105 10.6198 15.9216 9.84034 20.3868 8.77167 9.06389 15.9979 10.2668 numMergedOcc 0
12 mol 214 unq 5 iso 0 dist 8.95218 9.22105 10.6198 14.8373 8.07237 17.8673 8.77167 9.06389 15.9979 9.12568 numMergedOcc 0
13 mol 253 unq 0 iso 0 dist 7.06589 8.86676 5.68255 11.7205 8.70383 14.0165 5.90516 9.82605 10.2265 16.0043 numMergedOcc 0
14 mol 253 unq 1 iso 0 dist 7.06589 8.86676 5.68255 11.7205 8.70383 14.0165 4.67411 9.73723 8.66299 16.1168 numMergedOcc 0
15 mol 278 unq 0 iso 0 dist 8.60481 6.01365 10.5492 9.84223 9.58671 13.8888 6.59605 8.1769 12.1796 5.85558 numMergedOcc 0
16 mol 278 unq 1 iso 0 dist 8.60481 6.01365 10.5492 9.84223 9.58671 13.8888 5.55931 7.1656 9.32042 4.62289 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 5.62568 6.23874 5.9468 12.8716 8.82948 10.5202 10.0544 7.99204 10.9435 6.23875 numMergedOcc 0
18 mol 287 unq 1 iso 0 dist 5.62568 6.68956 3.63993 12.8716 8.82948 10.7429 10.0544 7.99204 11.2783 6.23875 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 5.62568 6.23874 5.9468 12.8716 8.82948 10.5202 10.0544 7.99204 10.9435 6.23875 numMergedOcc 0
20 mol 288 unq 1 iso 0 dist 5.62568 6.68956 3.63993 12.8716 8.82948 10.7429 10.0544 7.99204 11.2783 6.23875 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 5.62568 6.23874 5.9468 12.8716 8.82948 10.5202 10.0544 7.99204 10.9435 6.23875 numMergedOcc 0
22 mol 289 unq 1 iso 0 dist 5.62568 6.68956 3.63993 12.8716 8.82948 10.7429 10.0544 7.99204 11.2783 6.23875 numMergedOcc 0
