0 mol 83 unq 0 iso 0 dist 8.82069 10.4538 9.42195 14.0508 6.54198 8.57448 numMergedOcc 0
1 mol 83 unq 1 iso 0 dist 7.03997 8.10358 9.42195 6.97373 6.54198 8.57448 numMergedOcc 0
2 mol 91 unq 0 iso 0 dist 9.46176 10.1282 8.99674 9.96607 12.1497 9.13904 numMergedOcc 0
3 mol 91 unq 1 iso 0 dist 9.46176 10.1282 8.99674 6.18317 9.73719 7.10245 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 8.13828 8.73643 8.41086 8.29732 6.93115 5.71964 numMergedOcc 0
5 mol 120 unq 1 iso 0 dist 8.13828 8.73643 8.41086 8.73601 10.3855 6.82156 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 8.20417 4.60693 5.98187 12.8171 6.6925 8.57379 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 8.20417 8.07673 7.42186 13.8895 11.9106 5.87154 numMergedOcc 0
8 mol 123 unq 2 iso 0 dist 8.20417 8.07673 7.42186 12.8171 6.6925 6.82663 numMergedOcc 0
9 mol 123 unq 3 iso 0 dist 8.20417 7.83549 9.47346 16.2806 13.7302 9.93167 numMergedOcc 0
10 mol 162 unq 0 iso 0 dist 7.93315 12.7958 9.90113 11.9951 6.49195 5.96638 numMergedOcc 0
11 mol 250 unq 0 iso 0 dist 8.43155 6.25912 9.5174 14.605 11.4565 9.86436 numMergedOcc 0
12 mol 278 unq 0 iso 0 dist 7.39778 7.50114 5.79682 11.8229 7.02567 8.05084 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 5.72538 7.77692 5.62568 10.6117 5.41757 7.86603 numMergedOcc 0
14 mol 287 unq 1 iso 0 dist 5.72538 11.263 8.82948 10.6117 5.41757 7.17626 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 5.72538 7.77692 5.62568 10.6117 5.41757 7.86603 numMergedOcc 0
16 mol 288 unq 1 iso 0 dist 5.72538 11.263 8.82948 10.6117 5.41757 7.17626 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 5.72538 7.77692 5.62568 10.6117 5.41757 7.86603 numMergedOcc 0
18 mol 289 unq 1 iso 0 dist 5.72538 11.263 8.82948 10.6117 5.41757 7.17626 numMergedOcc 0
