0 mol 11 unq 0 iso 0 dist 9.88519 14.0373 9.99647 5.61631 8.70462 11.1377 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 8.06254 16.0601 9.99647 7.85023 8.70462 11.1377 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 6.32127 7.39264 8.98417 9.77186 9.5053 12.1122 numMergedOcc 0
3 mol 27 unq 0 iso 0 dist 5.80623 9.19908 7.96312 5.45556 7.45532 4.7474 numMergedOcc 0
4 mol 27 unq 1 iso 0 dist 5.80623 11.8741 7.67129 5.45556 7.45532 9.37609 numMergedOcc 0
5 mol 27 unq 2 iso 0 dist 7.24775 14.4555 7.96312 14.2929 7.45532 4.7474 numMergedOcc 0
6 mol 27 unq 3 iso 0 dist 7.24775 12.0486 7.67129 14.2929 7.45532 9.37609 numMergedOcc 0
7 mol 44 unq 0 iso 0 dist 9.52676 15.4323 9.98746 9.32021 7.03307 11.2391 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 7.85045 9.9965 8.03113 5.83414 8.79367 6.39362 numMergedOcc 0
9 mol 116 unq 1 iso 0 dist 7.85045 5.73517 9.2638 5.83414 8.79367 8.61652 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 8.41086 5.39993 8.64019 6.69527 6.03352 6.87987 numMergedOcc 0
11 mol 120 unq 1 iso 0 dist 7.41599 12.6549 8.64019 6.25626 6.03352 6.87987 numMergedOcc 0
12 mol 162 unq 0 iso 0 dist 9.90113 13.7363 6.80226 8.33753 7.58035 6.62679 numMergedOcc 0
13 mol 162 unq 1 iso 0 dist 9.90113 13.7363 6.80226 9.62474 8.21989 12.1377 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 6.21588 3.96829 8.82861 10.2224 5.91727 12.0796 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 9.47112 4.79799 6.23057 11.7574 8.07076 7.04224 numMergedOcc 0
16 mol 205 unq 1 iso 0 dist 9.47112 4.79799 6.23057 12.8469 5.95375 8.43505 numMergedOcc 0
17 mol 205 unq 2 iso 0 dist 9.47112 4.79799 6.23057 15.0925 9.17946 11.501 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 7.06589 9.07394 9.29788 5.37783 8.15091 4.60689 numMergedOcc 0
19 mol 253 unq 1 iso 0 dist 7.06589 11.6981 9.50983 5.37783 8.15091 9.18036 numMergedOcc 0
20 mol 253 unq 2 iso 0 dist 8.70383 14.7046 9.29788 14.5125 8.15091 4.60689 numMergedOcc 0
21 mol 253 unq 3 iso 0 dist 8.70383 12.0836 9.50983 14.5125 8.15091 9.18036 numMergedOcc 0
22 mol 272 unq 0 iso 0 dist 5.9131 9.49668 8.86801 7.94696 8.13034 15.7876 numMergedOcc 0
23 mol 272 unq 1 iso 0 dist 5.9131 4.36153 7.15093 7.94696 8.13034 11.2381 numMergedOcc 0
24 mol 272 unq 2 iso 0 dist 8.16917 13.1454 8.86801 12.6613 8.13034 15.7876 numMergedOcc 0
25 mol 272 unq 3 iso 0 dist 8.16917 13.7982 7.15093 12.6613 8.13034 11.2381 numMergedOcc 0
26 mol 278 unq 0 iso 0 dist 9.58671 12.4593 9.73172 5.37654 7.21972 7.10699 numMergedOcc 0
27 mol 278 unq 1 iso 0 dist 8.60481 12.229 9.73172 9.21229 7.21972 7.10699 numMergedOcc 0
