0 mol 32 unq 0 iso 0 dist 7.98414 9.16481 13.2652 10.2135 7.99969 13.8141 6.44894 4.62858 13.9281 6.68431 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 6.02731 5.6359 4.09232 11.4221 7.56205 9.69044 7.29999 6.04903 9.1062 11.7069 numMergedOcc 0
2 mol 62 unq 1 iso 0 dist 6.02731 5.6359 4.09232 4.05764 4.74544 6.9103 7.29999 6.04903 9.1062 5.49555 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 5.86118 5.35145 5.26394 6.24947 9.49144 11.1957 8.6915 9.0008 8.96498 13.2018 numMergedOcc 0
4 mol 67 unq 1 iso 0 dist 5.86118 5.35145 5.26394 6.24947 9.49144 11.1957 5.987 9.77887 10.9227 5.59327 numMergedOcc 0
5 mol 146 unq 0 iso 0 dist 6.28491 8.82192 8.9669 5.15943 8.84535 11.1134 10.8638 9.44952 16.2854 14.7359 numMergedOcc 0
6 mol 146 unq 1 iso 0 dist 6.28491 8.82192 8.9669 5.67737 8.82188 13.0837 10.8638 9.44952 16.2854 7.00857 numMergedOcc 0
7 mol 168 unq 0 iso 0 dist 8.80059 8.96534 16.2709 14.4671 7.44629 22.9388 8.27116 7.60254 16.5362 8.67522 numMergedOcc 0
8 mol 168 unq 1 iso 0 dist 8.80059 8.65328 12.6805 14.4671 7.44629 19.0785 8.27116 7.60254 13.1712 8.67522 numMergedOcc 0
9 mol 168 unq 2 iso 0 dist 8.80059 5.69346 7.61798 14.4671 7.44629 13.5658 8.27116 7.60254 10.8636 8.67522 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 9.89987 9.24772 6.39406 7.89844 6.2479 9.76212 13.7713 9.06217 14.5897 6.25083 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 9.89987 9.24772 6.39406 7.89844 6.2479 9.76212 9.77651 7.13252 12.3788 4.77278 numMergedOcc 0
12 mol 181 unq 2 iso 0 dist 9.89987 9.24772 6.39406 5.10258 6.22122 8.59874 13.7713 9.06217 14.5897 10.5753 numMergedOcc 0
13 mol 181 unq 3 iso 0 dist 9.89987 9.24772 6.39406 5.10258 6.22122 8.59874 9.77651 7.13252 12.3788 5.88819 numMergedOcc 0
14 mol 181 unq 4 iso 0 dist 9.89987 9.24772 6.39406 16.1714 7.99195 13.2783 13.7713 9.06217 14.5897 5.86342 numMergedOcc 0
15 mol 181 unq 5 iso 0 dist 9.89987 9.24772 6.39406 16.1714 7.99195 13.2783 9.77651 7.13252 12.3788 9.14057 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 8.28099 5.09756 4.03697 14.6912 7.76163 11.651 9.25757 9.84492 10.5584 10.5203 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 8.28099 5.09756 4.03697 6.15341 8.73217 6.61112 9.25757 9.84492 10.5584 11.7299 numMergedOcc 0
18 mol 186 unq 2 iso 0 dist 8.28099 7.44523 8.99937 14.6912 7.76163 16.1318 9.25757 9.84492 14.1428 10.5203 numMergedOcc 0
19 mol 186 unq 3 iso 0 dist 8.28099 7.44523 8.99937 6.15341 8.73217 11.4283 9.25757 9.84492 14.1428 11.7299 numMergedOcc 0
20 mol 232 unq 0 iso 0 dist 8.70651 7.13253 4.68548 9.88635 8.50102 11.4909 14.7996 7.17337 11.4566 8.78722 numMergedOcc 0
21 mol 232 unq 1 iso 0 dist 8.70651 7.13253 4.68548 5.08111 9.40808 10.3021 14.7996 7.17337 11.4566 13.5597 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 9.45787 4.37501 11.1693 5.19951 7.32499 8.84746 5.04225 7.43663 8.27411 5.9221 numMergedOcc 0
23 mol 234 unq 1 iso 0 dist 9.45787 4.37501 11.1693 5.19951 7.32499 8.84746 12.3321 7.94068 12.481 13.2297 numMergedOcc 0
24 mol 243 unq 0 iso 0 dist 7.24253 5.91328 10.1372 6.54531 7.49645 12.3379 5.32118 7.12785 9.33476 5.70464 numMergedOcc 0
25 mol 243 unq 1 iso 0 dist 7.24253 5.91328 10.1372 6.54531 7.49645 12.3379 11.4546 6.66959 15.4715 7.83758 numMergedOcc 0
26 mol 243 unq 2 iso 0 dist 7.24253 5.91328 10.1372 11.6229 9.9222 17.256 5.32118 7.12785 9.33476 10.3961 numMergedOcc 0
27 mol 243 unq 3 iso 0 dist 7.24253 5.91328 10.1372 11.6229 9.9222 17.256 11.4546 6.66959 15.4715 7.8399 numMergedOcc 0
28 mol 243 unq 4 iso 0 dist 7.24253 6.02146 12.4661 6.54531 7.49645 12.1846 5.32118 7.12785 9.57085 5.70464 numMergedOcc 0
29 mol 243 unq 5 iso 0 dist 7.24253 6.02146 12.4661 6.54531 7.49645 12.1846 11.4546 6.66959 16.9212 7.83758 numMergedOcc 0
30 mol 243 unq 6 iso 0 dist 7.24253 6.02146 12.4661 11.6229 9.9222 17.4392 5.32118 7.12785 9.57085 10.3961 numMergedOcc 0
31 mol 243 unq 7 iso 0 dist 7.24253 6.02146 12.4661 11.6229 9.9222 17.4392 11.4546 6.66959 16.9212 7.8399 numMergedOcc 0
32 mol 259 unq 0 iso 0 dist 9.98231 9.93282 4.47425 6.00315 7.98231 10.3406 11.4659 8.71497 6.23661 11.6195 numMergedOcc 0
33 mol 259 unq 1 iso 0 dist 9.98231 9.93282 4.47425 5.69584 7.08526 5.85442 11.4659 8.71497 6.23661 5.79468 numMergedOcc 0
34 mol 259 unq 2 iso 0 dist 9.98231 8.90555 4.10176 6.00315 7.98231 9.46361 11.4659 8.71497 9.43105 11.6195 numMergedOcc 0
35 mol 259 unq 3 iso 0 dist 9.98231 8.90555 4.10176 5.69584 7.08526 6.95511 11.4659 8.71497 9.43105 5.79468 numMergedOcc 0
