0 mol 21 unq 0 iso 0 dist 8.85347 5.0018 5.68808 7.30688 7.08873 8.64046 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 8.85347 5.0018 5.68808 6.70786 11.1907 9.1215 numMergedOcc 0
2 mol 21 unq 2 iso 0 dist 8.85347 5.0018 5.68808 8.16395 9.73407 9.60455 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.05728 5.0553 10.871 6.34215 9.49478 4.03744 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 8.125 8.91502 12.2547 6.34748 5.16401 12.4187 numMergedOcc 0
5 mol 56 unq 1 iso 0 dist 8.125 8.91502 12.2547 8.25594 13.2675 5.6898 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 9.7754 9.00217 10.135 8.52421 4.05832 6.8245 numMergedOcc 0
7 mol 78 unq 0 iso 0 dist 9.99029 7.85668 5.40759 9.71315 6.9648 4.28553 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 7.21902 9.0075 5.49165 7.15213 9.11305 6.35687 numMergedOcc 0
9 mol 130 unq 1 iso 0 dist 7.21902 9.0075 5.49165 8.86516 8.01674 3.38483 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 8.44823 5.35463 10.5856 6.75471 9.85734 3.90634 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 9.42819 9.98649 16.1113 6.51243 5.65603 10.533 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 8.84671 7.90789 9.27827 6.95244 7.73027 3.40693 numMergedOcc 0
13 mol 173 unq 1 iso 0 dist 8.84671 7.90789 9.27827 6.11224 8.97627 5.49842 numMergedOcc 0
14 mol 173 unq 2 iso 0 dist 8.84671 4.13397 6.37375 6.95244 7.73027 6.40851 numMergedOcc 0
15 mol 173 unq 3 iso 0 dist 8.84671 4.13397 6.37375 6.11224 8.97627 3.39015 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 8.32829 5.88987 12.5192 8.25953 15.9879 4.4877 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 9.08672 7.62128 13.9867 9.77333 7.31335 10.8024 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 7.30244 8.01243 14.1217 8.63649 14.9028 7.98284 numMergedOcc 0
19 mol 220 unq 1 iso 0 dist 7.30244 9.55264 3.91796 8.63649 14.9028 15.7445 numMergedOcc 0
20 mol 220 unq 2 iso 0 dist 7.29796 8.01243 9.83649 8.63649 14.1071 7.98284 numMergedOcc 0
21 mol 220 unq 3 iso 0 dist 7.29796 9.55264 10.4288 8.63649 14.1071 15.7445 numMergedOcc 0
22 mol 224 unq 0 iso 0 dist 7.04127 9.55911 4.32714 5.36326 5.13732 9.06907 numMergedOcc 0
23 mol 272 unq 0 iso 0 dist 8.82094 7.67597 9.75518 5.38409 5.12237 4.97184 numMergedOcc 0
24 mol 272 unq 1 iso 0 dist 9.80332 9.04936 9.75518 9.79769 7.99951 4.34432 numMergedOcc 0
25 mol 272 unq 2 iso 0 dist 9.80332 9.04936 9.75518 8.45524 5.12237 4.97184 numMergedOcc 0
26 mol 272 unq 3 iso 0 dist 9.80332 9.04936 9.75518 9.66055 5.41667 13.3663 numMergedOcc 0
