0 mol 0 unq 0 iso 0 dist 6.94181 5.98788 12.6486 7.49611 13.1231 6.91778 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 9.22151 8.00738 6.11127 11.2749 13.7311 8.6653 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 9.22151 8.00738 6.11127 4.96681 7.57578 7.92503 numMergedOcc 0
3 mol 25 unq 2 iso 0 dist 6.22122 8.00738 5.30154 11.2749 12.9968 8.6653 numMergedOcc 0
4 mol 25 unq 3 iso 0 dist 6.22122 8.00738 5.30154 4.96681 7.17969 7.92503 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 6.54183 8.60653 5.99981 5.65405 8.10861 7.21717 numMergedOcc 0
6 mol 61 unq 0 iso 0 dist 9.70415 5.67362 13.5488 5.46309 6.65721 9.25641 numMergedOcc 0
7 mol 67 unq 0 iso 0 dist 8.70949 9.67641 13.6485 7.70042 14.0024 9.49144 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 8.46684 5.9575 5.31484 6.23018 11.4095 6.92026 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 8.46684 5.9575 5.31484 5.14332 6.90986 5.88249 numMergedOcc 0
10 mol 115 unq 2 iso 0 dist 8.46684 5.9575 5.31484 5.28643 5.39945 6.97707 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 8.88255 8.61574 9.89358 10.5726 8.73993 9.23858 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 8.90009 9.57532 6.19368 12.1367 14.6242 9.23858 numMergedOcc 0
13 mol 156 unq 0 iso 0 dist 9.68507 6.40435 6.03934 11.0374 12.0598 9.44367 numMergedOcc 0
14 mol 156 unq 1 iso 0 dist 9.68507 6.40435 6.03934 9.75709 7.66148 7.90267 numMergedOcc 0
15 mol 180 unq 0 iso 0 dist 9.90787 9.59587 5.67701 6.93557 10.0102 5.85827 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 8.90247 9.99409 8.91338 5.114 9.1374 8.90963 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 6.58792 9.99409 11.85 5.114 9.94371 8.90963 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 5.16813 5.77158 5.4141 5.87924 9.70748 7.66165 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 6.21273 7.58118 7.11498 5.1021 9.23153 6.59716 numMergedOcc 0
20 mol 227 unq 0 iso 0 dist 7.71761 6.65275 6.48027 5.841 7.55216 5.41321 numMergedOcc 0
21 mol 238 unq 0 iso 0 dist 5.67917 8.52162 8.1195 11.6549 13.9668 8.94014 numMergedOcc 0
22 mol 238 unq 1 iso 0 dist 5.67917 8.52162 8.1195 12.9109 12.8275 7.02333 numMergedOcc 0
23 mol 238 unq 2 iso 0 dist 5.67917 8.52162 8.1195 12.3128 10.7456 8.67864 numMergedOcc 0
24 mol 238 unq 3 iso 0 dist 8.96639 8.52162 13.49 11.6549 18.8526 8.94014 numMergedOcc 0
25 mol 238 unq 4 iso 0 dist 8.96639 8.52162 13.49 12.9109 17.9526 7.02333 numMergedOcc 0
26 mol 238 unq 5 iso 0 dist 8.96639 8.52162 13.49 12.3128 15.0311 8.67864 numMergedOcc 0
27 mol 239 unq 0 iso 0 dist 8.7017 6.47859 5.05321 9.78463 13.6473 9.01021 numMergedOcc 0
