0 mol 24 unq 0 iso 0 dist 6.72502 5.11636 8.24948 8.60554 6.99746 5.80953 13.2846 13.1457 11.1587 7.85986 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.72502 5.11636 8.24948 8.60554 6.99746 5.80953 12.3897 11.1639 8.72577 4.30252 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 6.61823 5.31547 6.98037 9.75237 8.67827 6.59716 5.94724 10.3338 8.74506 9.69694 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 6.61823 4.3481 6.9223 9.75237 8.67827 6.87506 5.94724 10.3338 3.70642 9.69694 numMergedOcc 0
4 mol 92 unq 2 iso 0 dist 6.49956 4.3481 7.0561 9.75237 13.0818 6.87506 5.94724 7.7346 3.70642 9.69694 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 9.81831 16.1023 7.8435 24.4789 15.8624 9.19977 27.8724 20.2438 13.1331 5.56839 numMergedOcc 0
6 mol 93 unq 1 iso 0 dist 9.81831 16.1023 7.8435 23.3751 14.7862 7.28831 27.8724 20.2438 13.1331 7.83506 numMergedOcc 0
7 mol 93 unq 2 iso 0 dist 9.12858 12.4934 7.8435 20.2792 15.8624 9.19977 22.8272 20.2438 13.1331 5.56839 numMergedOcc 0
8 mol 93 unq 3 iso 0 dist 9.12858 12.4934 7.8435 19.3357 14.7862 7.28831 22.8272 20.2438 13.1331 7.83506 numMergedOcc 0
9 mol 93 unq 4 iso 0 dist 9.4523 10.8106 7.8435 19.7304 15.8624 9.19977 22.5206 20.2438 13.1331 5.56839 numMergedOcc 0
10 mol 93 unq 5 iso 0 dist 9.4523 10.8106 7.8435 17.211 14.7862 7.28831 22.5206 20.2438 13.1331 7.83506 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 9.15431 4.57579 6.78801 10.8571 5.66194 7.75314 6.59442 9.58379 6.95147 7.84546 numMergedOcc 0
12 mol 131 unq 1 iso 0 dist 6.92648 8.57203 6.78801 11.8964 5.66194 7.75314 11.499 9.58379 6.95147 7.84546 numMergedOcc 0
13 mol 131 unq 2 iso 0 dist 9.29384 12.6005 6.78801 14.9021 5.66194 7.75314 17.1677 9.58379 6.95147 7.84546 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 6.69515 13.2918 6.77921 11.0743 5.38571 6.65731 11.8444 10.8548 14.5559 9.38036 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 7.86572 13.4066 6.77921 9.97343 5.38571 6.65731 6.45283 10.8548 14.5559 9.38036 numMergedOcc 0
16 mol 158 unq 0 iso 0 dist 7.88319 13.7172 6.11331 14.6377 10.8263 9.97968 6.60451 8.06621 11.6769 9.45696 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 7.28841 8.0472 8.17226 11.0128 5.80425 8.92115 16.554 14.3247 11.6544 9.31569 numMergedOcc 0
18 mol 188 unq 0 iso 0 dist 8.57261 9.71636 7.79115 7.14503 5.0782 8.66624 8.02684 6.18257 3.42559 8.34477 numMergedOcc 0
19 mol 194 unq 0 iso 0 dist 6.26839 10.0756 5.53324 8.65535 5.92931 4.19371 12.8006 12.7017 9.23342 8.43182 numMergedOcc 0
20 mol 194 unq 1 iso 0 dist 8.12346 10.2793 5.53324 12.0009 5.92931 4.19371 14.1924 12.7017 9.23342 8.43182 numMergedOcc 0
21 mol 194 unq 2 iso 0 dist 8.83356 10.463 5.53324 12.645 5.92931 4.19371 19.6676 12.7017 9.23342 8.43182 numMergedOcc 0
22 mol 194 unq 3 iso 0 dist 8.2654 12.8494 5.53324 13.9101 5.92931 4.19371 18.7581 12.7017 9.23342 8.43182 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 7.71657 4.74189 8.20485 10.1085 8.62248 9.63518 7.84345 13.1667 9.39944 9.32971 numMergedOcc 0
