0 mol 12 unq 0 iso 0 dist 8.34132 6.16894 8.98466 10.5042 6.89226 8.17618 numMergedOcc 0
1 mol 42 unq 0 iso 0 dist 9.52043 4.8523 8.84148 12.1266 6.73507 8.52254 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 8.58684 16.0902 9.3473 18.0141 9.82646 9.10915 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 8.58684 16.0902 9.3473 17.7566 9.96083 7.02352 numMergedOcc 0
4 mol 64 unq 2 iso 0 dist 8.58684 13.4736 8.14932 18.0141 9.82646 8.66921 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 9.81722 12.7037 5.39171 14.5044 8.04817 4.24428 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 9.81722 12.7037 5.39171 10.4812 5.2774 6.30194 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 8.27446 14.5698 9.27355 13.2197 9.76331 4.24428 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 8.27446 14.5698 9.27355 11.3406 5.44275 6.30194 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 9.76332 14.5698 8.60363 13.2197 10.4402 4.24428 numMergedOcc 0
10 mol 73 unq 5 iso 0 dist 9.76332 14.5698 8.60363 11.3406 8.0624 6.30194 numMergedOcc 0
11 mol 100 unq 0 iso 0 dist 9.27657 4.25275 6.60356 12.0862 14.3495 9.57498 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 6.1299 4.82452 6.68364 7.73769 5.4432 5.30872 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 8.68723 5.43254 5.97008 13.4401 8.75092 8.84671 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.76509 6.46011 7.02662 11.4689 6.3719 6.99623 numMergedOcc 0
15 mol 217 unq 0 iso 0 dist 9.30247 9.14625 6.01666 10.2372 5.42652 9.90668 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 8.80237 5.94768 9.86417 12.9413 9.38348 9.88212 numMergedOcc 0
17 mol 220 unq 0 iso 0 dist 8.71376 10.5175 8.98362 12.6429 6.80494 9.85951 numMergedOcc 0
18 mol 231 unq 0 iso 0 dist 6.00509 5.36501 7.28719 6.02527 5.3251 9.98232 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 9.46904 5.55077 8.34832 12.4713 11.4465 9.27989 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 9.51551 5.09576 6.5072 11.0754 12.4903 7.54805 numMergedOcc 0
21 mol 265 unq 1 iso 0 dist 8.25956 5.09576 4.03921 11.0754 5.11366 7.54805 numMergedOcc 0
22 mol 281 unq 0 iso 0 dist 7.9542 4.93146 6.7897 12.7097 5.71767 9.48968 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 8.5942 5.60271 8.08495 8.33653 8.39941 7.66291 numMergedOcc 0
