0 mol 0 unq 0 iso 0 dist 8.24206 7.79534 6.63977 5.25456 7.37981 7.40865 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.19218 7.79534 4.76647 5.25456 7.19621 7.40865 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 8.28883 8.68989 3.95005 5.72813 7.54318 10.2934 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.4438 6.82707 7.94629 15.6609 9.28253 10.7524 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 8.67865 6.15654 9.52463 5.1767 4.98104 6.95572 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 8.67865 7.89887 6.07224 5.1767 4.98104 7.38677 numMergedOcc 0
6 mol 102 unq 0 iso 0 dist 5.43401 9.2062 5.6591 7.49575 9.10229 9.24642 numMergedOcc 0
7 mol 111 unq 0 iso 0 dist 8.83191 9.63728 5.67736 13.3198 8.42147 12.9634 numMergedOcc 0
8 mol 120 unq 0 iso 0 dist 9.18835 5.12002 10.1606 10.5162 8.91606 14.2373 numMergedOcc 0
9 mol 120 unq 1 iso 0 dist 9.18835 8.46914 5.30162 10.5162 8.91606 12.9184 numMergedOcc 0
10 mol 126 unq 0 iso 0 dist 7.25133 6.62527 11.5654 4.57807 7.11388 11.1956 numMergedOcc 0
11 mol 126 unq 1 iso 0 dist 7.25133 6.62527 11.5654 13.2652 8.83131 19.1694 numMergedOcc 0
12 mol 194 unq 0 iso 0 dist 5.69763 6.57575 6.38935 11.4562 9.48439 6.72379 numMergedOcc 0
13 mol 194 unq 1 iso 0 dist 7.38622 9.30761 7.75447 5.55582 7.32478 6.72379 numMergedOcc 0
14 mol 194 unq 2 iso 0 dist 8.82165 9.30761 6.38935 5.55582 9.48439 6.72379 numMergedOcc 0
15 mol 197 unq 0 iso 0 dist 8.51118 9.87211 4.91904 8.58314 8.64255 7.50013 numMergedOcc 0
16 mol 197 unq 1 iso 0 dist 8.51118 6.3997 7.59634 8.58314 8.64255 5.81233 numMergedOcc 0
17 mol 198 unq 0 iso 0 dist 4.58291 8.28295 5.47473 4.81051 6.47339 6.34616 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 9.17355 9.33514 13.1451 8.70715 8.48112 11.1525 numMergedOcc 0
19 mol 220 unq 1 iso 0 dist 7.86207 7.46122 4.39102 10.6943 9.8711 6.59716 numMergedOcc 0
20 mol 220 unq 2 iso 0 dist 7.57712 8.75712 11.317 6.19375 7.31105 13.5821 numMergedOcc 0
21 mol 226 unq 0 iso 0 dist 7.20862 5.3747 8.58832 10.5706 9.5723 15.1921 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 6.44266 9.35929 10.3973 6.98398 7.80446 13.2932 numMergedOcc 0
23 mol 274 unq 1 iso 0 dist 6.44266 9.35929 10.3973 6.99898 9.86142 15.8746 numMergedOcc 0
24 mol 274 unq 2 iso 0 dist 8.75703 9.35929 5.43792 6.98398 9.91395 13.2932 numMergedOcc 0
