0 mol 8 unq 0 iso 0 dist 7.58816 8.79328 4.92734 14.0444 7.97177 8.53529 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 7.58816 8.5845 6.57999 14.0444 7.97177 7.18019 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 9.62336 10.1382 7.62791 12.0814 5.47666 9.97775 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 9.03472 4.56886 5.90776 9.7872 5.47738 5.37007 numMergedOcc 0
4 mol 92 unq 1 iso 0 dist 9.40274 5.1219 5.90776 10.2815 5.47738 5.37007 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 8.04448 8.91618 6.78839 12.3507 7.22196 5.78706 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 8.04448 14.8024 8.02354 12.3507 7.22196 5.59328 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.27253 10.7421 7.85527 8.75431 7.21894 8.99399 numMergedOcc 0
8 mol 125 unq 0 iso 0 dist 8.12448 4.71345 6.03557 10.5025 6.46489 7.73435 numMergedOcc 0
9 mol 125 unq 1 iso 0 dist 8.12448 4.71345 6.03557 10.173 8.27647 9.3778 numMergedOcc 0
10 mol 129 unq 0 iso 0 dist 9.66828 7.59962 6.23966 13.3186 6.47522 6.28565 numMergedOcc 0
11 mol 129 unq 1 iso 0 dist 9.66828 7.59962 6.23966 9.86988 5.85167 7.58957 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 6.80942 4.94973 5.68636 10.9644 5.52764 7.92304 numMergedOcc 0
13 mol 195 unq 0 iso 0 dist 9.39697 8.95444 8.3705 16.7291 11.3703 9.26504 numMergedOcc 0
14 mol 212 unq 0 iso 0 dist 8.85976 14.7053 9.47932 14.9363 9.63106 9.74144 numMergedOcc 0
15 mol 212 unq 1 iso 0 dist 8.85976 14.7053 9.47932 18.9786 10.6561 8.69988 numMergedOcc 0
16 mol 212 unq 2 iso 0 dist 8.85976 14.7053 9.47932 22.2425 15.0782 8.55903 numMergedOcc 0
17 mol 212 unq 3 iso 0 dist 8.85976 14.7053 9.47932 15.2597 7.56072 7.15603 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 7.03782 4.4049 5.82876 10.4237 4.48276 7.46394 numMergedOcc 0
19 mol 274 unq 1 iso 0 dist 7.03782 10.4747 8.71129 10.4237 4.48276 7.1729 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 9.24895 4.79698 5.70546 9.5146 4.99186 7.23721 numMergedOcc 0
21 mol 279 unq 1 iso 0 dist 8.34154 10.5081 5.70546 13.1175 4.99186 7.23721 numMergedOcc 0
