0 mol 51 unq 0 iso 0 dist 9.53744 6.67213 5.8664 8.92175 4.50391 4.32726 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 8.37315 6.81152 5.44326 8.3736 6.13072 9.9157 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 9.28709 6.77833 6.95018 8.63204 15.5707 12.7012 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 9.28709 6.77833 6.95018 5.4014 10.7012 8.20805 numMergedOcc 0
4 mol 89 unq 0 iso 0 dist 9.04932 8.85873 12.1771 7.02228 9.44832 6.13636 numMergedOcc 0
5 mol 89 unq 1 iso 0 dist 9.04932 7.3606 5.91348 7.02228 9.44832 4.16955 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 5.99463 7.90775 10.7626 7.84956 5.80449 7.45908 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 5.99463 7.90775 10.7626 8.57607 12.9542 4.99174 numMergedOcc 0
8 mol 95 unq 2 iso 0 dist 5.99463 7.90775 10.7626 6.1991 10.665 4.46005 numMergedOcc 0
9 mol 95 unq 3 iso 0 dist 5.99463 7.90775 10.7626 5.96246 5.91949 8.28518 numMergedOcc 0
10 mol 95 unq 4 iso 0 dist 5.99463 8.49531 4.6558 7.84956 5.80449 10.2496 numMergedOcc 0
11 mol 95 unq 5 iso 0 dist 5.99463 8.49531 4.6558 8.57607 12.9542 16.6518 numMergedOcc 0
12 mol 95 unq 6 iso 0 dist 5.99463 8.49531 4.6558 6.1991 10.665 13.1525 numMergedOcc 0
13 mol 95 unq 7 iso 0 dist 5.99463 8.49531 4.6558 5.96246 5.91949 7.26851 numMergedOcc 0
14 mol 109 unq 0 iso 0 dist 8.74797 9.26438 9.25015 6.62354 4.71888 5.00433 numMergedOcc 0
15 mol 122 unq 0 iso 0 dist 6.12598 8.47907 11.4252 6.91978 5.69357 6.9791 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 9.17599 8.31276 10.1166 7.96353 14.49 15.3018 numMergedOcc 0
17 mol 134 unq 1 iso 0 dist 9.17599 5.79157 7.18189 7.96353 14.49 10.7951 numMergedOcc 0
18 mol 134 unq 2 iso 0 dist 9.17599 5.50687 12.935 7.96353 14.49 5.4761 numMergedOcc 0
19 mol 134 unq 3 iso 0 dist 9.17599 7.30919 10.3773 7.96353 14.49 5.03507 numMergedOcc 0
20 mol 134 unq 4 iso 0 dist 8.78704 8.31276 15.4311 7.96353 9.10659 15.3018 numMergedOcc 0
21 mol 134 unq 5 iso 0 dist 8.78704 5.79157 5.87684 7.96353 9.10659 10.7951 numMergedOcc 0
22 mol 134 unq 6 iso 0 dist 8.78704 5.50687 8.05964 7.96353 9.10659 5.4761 numMergedOcc 0
23 mol 134 unq 7 iso 0 dist 8.78704 7.30919 5.11977 7.96353 9.10659 5.03507 numMergedOcc 0
24 mol 236 unq 0 iso 0 dist 7.89041 8.95071 7.41111 5.9625 4.76073 10.5937 numMergedOcc 0
25 mol 248 unq 0 iso 0 dist 8.2748 7.40475 6.21372 5.65458 6.29802 7.48679 numMergedOcc 0
26 mol 266 unq 0 iso 0 dist 4.74121 6.95233 10.6075 7.30349 8.67316 6.17213 numMergedOcc 0
27 mol 266 unq 1 iso 0 dist 4.74121 9.61741 11.4012 7.30349 8.67316 10.9352 numMergedOcc 0
28 mol 266 unq 2 iso 0 dist 4.74121 5.61056 7.43125 7.30349 8.67316 4.0027 numMergedOcc 0
