0 mol 0 unq 0 iso 0 dist 7.48645 5.92155 6.43144 6.0597 6.64713 4.60559 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 8.94096 6.84097 8.3997 12.7056 8.77457 6.65707 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 9.07858 14.5081 8.3997 16.8602 8.77457 6.65707 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 9.82483 15.0684 7.51584 6.0397 8.076 10.8146 numMergedOcc 0
4 mol 9 unq 1 iso 0 dist 7.25684 5.26687 7.88249 5.77558 9.3523 10.433 numMergedOcc 0
5 mol 9 unq 2 iso 0 dist 8.22285 15.0721 7.88249 10.5584 9.3523 10.433 numMergedOcc 0
6 mol 13 unq 0 iso 0 dist 8.00865 5.47592 8.81649 15.907 7.98679 15.4372 numMergedOcc 0
7 mol 13 unq 1 iso 0 dist 9.11447 14.0992 8.81649 15.0129 7.98679 15.4372 numMergedOcc 0
8 mol 52 unq 0 iso 0 dist 8.65019 10.4146 7.59119 4.70551 9.80143 10.1588 numMergedOcc 0
9 mol 56 unq 0 iso 0 dist 5.86571 4.59391 8.76402 6.56778 6.99108 8.84582 numMergedOcc 0
10 mol 56 unq 1 iso 0 dist 5.86571 8.7005 5.6727 6.56778 6.99108 5.2676 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 7.59814 4.7742 7.03758 6.15037 7.82544 4.29098 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 8.07135 9.5551 9.31778 6.61001 6.18808 4.29098 numMergedOcc 0
13 mol 133 unq 2 iso 0 dist 9.7775 4.7742 9.31778 6.15037 6.18808 4.29098 numMergedOcc 0
14 mol 154 unq 0 iso 0 dist 9.47362 6.38905 9.79706 12.7281 6.51014 12.5387 numMergedOcc 0
15 mol 154 unq 1 iso 0 dist 9.47362 13.1574 9.31487 12.7281 6.51014 7.22175 numMergedOcc 0
16 mol 154 unq 2 iso 0 dist 6.28417 14.4117 9.79706 4.70993 6.51014 12.5387 numMergedOcc 0
17 mol 154 unq 3 iso 0 dist 6.28417 8.94904 9.31487 4.70993 6.51014 7.22175 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 7.01126 10.9284 9.58615 4.30489 5.89564 13.3214 numMergedOcc 0
19 mol 175 unq 1 iso 0 dist 7.01126 10.9284 9.58615 4.57622 5.60528 6.94267 numMergedOcc 0
20 mol 175 unq 2 iso 0 dist 6.58434 10.9284 6.83568 4.57622 5.5995 6.94267 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 5.49808 5.3049 9.2826 4.46559 9.26796 6.47613 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 7.96291 10.8044 9.2826 9.08227 9.26796 6.47613 numMergedOcc 0
23 mol 210 unq 0 iso 0 dist 6.4829 8.36689 8.85757 5.96222 5.57779 7.3096 numMergedOcc 0
24 mol 210 unq 1 iso 0 dist 6.4829 8.36689 8.85757 10.1011 7.05649 4.78236 numMergedOcc 0
25 mol 210 unq 2 iso 0 dist 6.4829 8.36689 8.85757 12.5026 6.78579 10.2135 numMergedOcc 0
26 mol 225 unq 0 iso 0 dist 7.29542 9.68884 5.40513 9.51752 9.23935 9.71118 numMergedOcc 0
27 mol 225 unq 1 iso 0 dist 7.29542 9.68884 5.40513 10.9596 7.77552 7.00757 numMergedOcc 0
28 mol 237 unq 0 iso 0 dist 7.33613 4.7071 6.68833 4.7134 6.07878 5.76833 numMergedOcc 0
29 mol 237 unq 1 iso 0 dist 7.33613 4.7071 6.68833 6.42587 7.80422 9.96763 numMergedOcc 0
30 mol 237 unq 2 iso 0 dist 7.33613 4.7071 6.68833 9.55218 5.06628 10.9723 numMergedOcc 0
31 mol 264 unq 0 iso 0 dist 9.42738 4.59547 6.74637 10.6815 7.21655 10.8008 numMergedOcc 0
32 mol 272 unq 0 iso 0 dist 6.98048 6.80602 8.9477 5.42668 8.13034 5.85562 numMergedOcc 0
