0 mol 62 unq 0 iso 0 dist 6.02731 5.6359 4.09232 4.05764 4.74544 6.9103 4.85282 7.46975 5.46563 8.1599 numMergedOcc 0
1 mol 109 unq 0 iso 0 dist 6.65318 5.15951 7.60413 7.12509 6.60933 9.65809 14.2517 9.51381 14.7938 8.35636 numMergedOcc 0
2 mol 171 unq 0 iso 0 dist 8.53734 7.87612 11.4427 11.071 9.61462 18.0601 7.7195 4.98945 13.0669 6.07091 numMergedOcc 0
3 mol 171 unq 1 iso 0 dist 6.08141 5.98495 4.88147 10.3893 9.61462 13.5 8.30819 4.98945 9.74745 6.07091 numMergedOcc 0
4 mol 181 unq 0 iso 0 dist 9.89987 9.24772 6.39406 5.10258 6.22122 8.59874 13.1737 12.0718 17.3349 9.58911 numMergedOcc 0
5 mol 196 unq 0 iso 0 dist 4.83135 9.95371 11.8216 9.99132 6.86319 15.202 15.5979 11.4857 16.7145 8.79558 numMergedOcc 0
6 mol 232 unq 0 iso 0 dist 8.70651 7.13253 4.68548 9.88635 8.50102 11.4909 8.15743 6.36084 6.54593 7.70279 numMergedOcc 0
7 mol 232 unq 1 iso 0 dist 8.70651 7.13253 4.68548 5.08111 9.40808 10.3021 8.15743 6.36084 6.54593 9.29752 numMergedOcc 0
8 mol 234 unq 0 iso 0 dist 8.88567 4.37501 10.2835 5.19951 6.30154 8.84746 5.67249 6.06471 4.86668 7.46434 numMergedOcc 0
9 mol 234 unq 1 iso 0 dist 8.88567 4.37501 10.2835 5.19951 6.30154 8.84746 12.2496 11.2248 16.2601 7.50424 numMergedOcc 0
10 mol 234 unq 2 iso 0 dist 9.45787 4.37501 11.1693 5.19951 7.32499 8.84746 5.67249 11.1213 4.86668 7.46434 numMergedOcc 0
11 mol 234 unq 3 iso 0 dist 9.45787 4.37501 11.1693 5.19951 7.32499 8.84746 12.2496 10.6488 16.2601 7.50424 numMergedOcc 0
12 mol 243 unq 0 iso 0 dist 7.24253 5.91328 10.1372 6.54531 7.49645 12.3379 5.1766 3.87679 8.61196 6.86162 numMergedOcc 0
13 mol 243 unq 1 iso 0 dist 7.24253 6.02146 12.4661 6.54531 7.49645 12.1846 5.1766 3.87679 10.4256 6.86162 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 7.41653 8.34536 12.4315 6.88723 9.63959 12.7392 10.577 5.32742 14.1712 9.59174 numMergedOcc 0
15 mol 259 unq 0 iso 0 dist 9.98231 9.93282 4.47425 6.00315 7.98231 10.3406 12.6191 5.61261 10.0741 8.06771 numMergedOcc 0
16 mol 259 unq 1 iso 0 dist 9.98231 9.93282 4.47425 5.69584 7.08526 5.85442 11.678 8.74892 5.49348 9.54857 numMergedOcc 0
17 mol 259 unq 2 iso 0 dist 9.98231 8.90555 4.10176 6.00315 7.98231 9.46361 12.6191 5.61261 9.0675 8.06771 numMergedOcc 0
18 mol 259 unq 3 iso 0 dist 9.98231 8.90555 4.10176 5.69584 7.08526 6.95511 11.678 8.74892 5.13138 9.54857 numMergedOcc 0
