0 mol 8 unq 0 iso 0 dist 6.68091 9.62683 8.89145 11.4765 9.95165 12.1308 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 6.68091 7.08043 6.92865 11.4765 9.95165 5.02333 numMergedOcc 0
2 mol 67 unq 0 iso 0 dist 8.34804 11.9474 7.9572 12.6838 6.0478 5.6313 numMergedOcc 0
3 mol 67 unq 1 iso 0 dist 8.34804 16.4344 8.64208 12.6838 6.0478 4.72525 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 7.61312 7.83419 9.22376 4.81974 9.924 10.121 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 5.53726 4.33359 6.30103 6.24893 6.97288 4.24513 numMergedOcc 0
6 mol 103 unq 0 iso 0 dist 8.1375 8.44658 7.55805 5.74649 9.39702 6.29991 numMergedOcc 0
7 mol 124 unq 0 iso 0 dist 9.7589 9.34008 7.23052 9.18927 4.83761 9.70339 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 9.92685 10.5415 9.05626 7.19014 4.85559 5.97111 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 7.63904 5.5065 9.04554 7.86748 6.31314 6.55507 numMergedOcc 0
10 mol 163 unq 0 iso 0 dist 6.89529 4.12904 6.56115 3.64474 9.02124 6.94217 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 6.20851 9.22906 6.01711 5.31547 6.81707 5.487 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 6.7407 8.6578 8.70197 10.6359 7.70692 5.5127 numMergedOcc 0
13 mol 173 unq 1 iso 0 dist 8.84813 6.91967 8.84671 11.4674 4.0037 10.7924 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 5.83898 9.40372 9.08672 9.4839 5.67811 5.81909 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 5.83898 9.40372 9.08672 10.0038 8.74308 14.4635 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 8.55805 15.5892 7.30244 8.04161 8.31564 14.3172 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 8.55805 15.0704 7.29796 8.04161 8.31564 11.1607 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 6.28023 4.4049 9.81087 4.85537 9.4626 7.52207 numMergedOcc 0
19 mol 279 unq 0 iso 0 dist 9.56601 7.84864 6.47376 5.95068 7.5355 6.15987 numMergedOcc 0
20 mol 279 unq 1 iso 0 dist 6.70261 7.84864 9.6147 5.95068 7.88343 6.15987 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 6.90956 5.25853 7.30618 5.43917 9.18774 9.92109 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 6.90956 5.25853 7.30618 5.43917 9.18774 9.92109 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 6.90956 5.25853 7.30618 5.43917 9.18774 9.92109 numMergedOcc 0
