0 mol 15 unq 0 iso 0 dist 9.63035 4.89563 6.78983 6.66625 9.11751 9.29358 numMergedOcc 0
1 mol 114 unq 0 iso 0 dist 8.14574 7.91231 11.1664 9.88102 9.9778 15.5024 numMergedOcc 0
2 mol 114 unq 1 iso 0 dist 8.14574 7.91231 11.1664 5.03825 6.27701 12.1525 numMergedOcc 0
3 mol 129 unq 0 iso 0 dist 5.92115 9.06272 6.13737 4.90946 9.50776 11.8081 numMergedOcc 0
4 mol 186 unq 0 iso 0 dist 8.39237 5.47189 13.4775 12.8874 7.46024 18.264 numMergedOcc 0
5 mol 198 unq 0 iso 0 dist 5.42463 7.96375 6.51118 5.75622 9.3526 7.21533 numMergedOcc 0
6 mol 228 unq 0 iso 0 dist 8.27678 8.89311 4.83458 15.3451 8.2286 12.1564 numMergedOcc 0
7 mol 228 unq 1 iso 0 dist 9.75578 9.46214 10.0045 13.1757 8.2286 14.3766 numMergedOcc 0
8 mol 228 unq 2 iso 0 dist 8.73196 9.51602 5.34643 5.55391 8.2286 7.65132 numMergedOcc 0
9 mol 228 unq 3 iso 0 dist 8.52422 9.46214 5.34702 5.86537 8.5965 7.94506 numMergedOcc 0
10 mol 228 unq 4 iso 0 dist 8.26664 8.81885 4.84511 15.7915 8.5965 12.381 numMergedOcc 0
11 mol 228 unq 5 iso 0 dist 9.68484 9.51602 9.98626 13.673 8.5965 14.7577 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 9.26228 9.85618 8.05458 4.99523 9.53123 12.3502 numMergedOcc 0
13 mol 243 unq 0 iso 0 dist 6.0854 8.19458 7.07529 13.3811 8.75924 8.61104 numMergedOcc 0
14 mol 243 unq 1 iso 0 dist 6.0854 9.45133 9.86055 13.3811 8.75924 13.2221 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 6.95552 8.26503 6.96581 6.43567 9.77741 13.4366 numMergedOcc 0
16 mol 258 unq 1 iso 0 dist 6.95552 9.80417 5.38982 6.43567 9.77741 12.5439 numMergedOcc 0
17 mol 270 unq 0 iso 0 dist 6.17797 9.02113 13.1723 9.0548 9.91826 17.8505 numMergedOcc 0
18 mol 271 unq 0 iso 0 dist 8.56431 7.59727 5.49799 6.75816 8.6344 11.1285 numMergedOcc 0
