0 mol 0 unq 0 iso 0 dist 5.98788 8.65478 3.59834 7.49611 6.91778 10.1245 numMergedOcc 0
1 mol 4 unq 0 iso 0 dist 6.10734 9.97548 8.93987 12.7044 8.24634 16.066 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 8.60653 9.63616 14.2852 5.65405 7.21717 8.31068 numMergedOcc 0
3 mol 115 unq 0 iso 0 dist 5.9575 9.22398 8.16155 6.23018 6.92026 13.9164 numMergedOcc 0
4 mol 115 unq 1 iso 0 dist 5.9575 9.22398 8.16155 5.14332 5.88249 9.28256 numMergedOcc 0
5 mol 115 unq 2 iso 0 dist 5.9575 9.22398 8.16155 5.28643 6.97707 4.76974 numMergedOcc 0
6 mol 130 unq 0 iso 0 dist 6.87196 8.12319 3.88766 5.25879 8.78276 8.81797 numMergedOcc 0
7 mol 130 unq 1 iso 0 dist 6.87196 8.12319 3.88766 5.26656 7.88805 9.81269 numMergedOcc 0
8 mol 130 unq 2 iso 0 dist 6.87196 8.12319 3.88766 10.9365 7.96646 5.92733 numMergedOcc 0
9 mol 130 unq 3 iso 0 dist 6.87196 8.12319 3.88766 10.6181 7.90048 10.8305 numMergedOcc 0
10 mol 131 unq 0 iso 0 dist 5.43662 8.44004 5.92118 5.29825 8.70296 8.80895 numMergedOcc 0
11 mol 168 unq 0 iso 0 dist 8.30857 7.667 5.71136 7.26802 7.44629 8.92592 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 5.25309 8.07518 3.67187 7.07865 5.94469 8.86172 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 5.25309 7.39733 3.63671 7.07865 5.94469 8.29467 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 6.65725 9.511 4.79971 7.25468 6.42735 11.0396 numMergedOcc 0
15 mol 184 unq 1 iso 0 dist 6.65725 7.72354 5.05856 7.25468 6.42735 9.84566 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 9.819 7.26295 3.7326 15.6354 8.65535 9.52922 numMergedOcc 0
17 mol 194 unq 1 iso 0 dist 9.819 7.31316 7.29209 15.6354 8.65535 11.7672 numMergedOcc 0
18 mol 204 unq 0 iso 0 dist 6.62013 5.8294 6.52211 7.24163 7.32294 11.6168 numMergedOcc 0
19 mol 284 unq 0 iso 0 dist 5.24993 6.61811 3.57807 5.87119 6.78191 10.0727 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 8.53802 9.2144 5.9468 14.2602 6.89451 11.5975 numMergedOcc 0
21 mol 287 unq 1 iso 0 dist 8.53802 8.36585 3.63993 14.2602 6.89451 10.2063 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 8.53802 9.2144 5.9468 14.2602 6.89451 11.5975 numMergedOcc 0
23 mol 288 unq 1 iso 0 dist 8.53802 8.36585 3.63993 14.2602 6.89451 10.2063 numMergedOcc 0
24 mol 289 unq 0 iso 0 dist 8.53802 9.2144 5.9468 14.2602 6.89451 11.5975 numMergedOcc 0
25 mol 289 unq 1 iso 0 dist 8.53802 8.36585 3.63993 14.2602 6.89451 10.2063 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 6.68183 8.27039 5.06937 5.81799 7.07965 4.49592 numMergedOcc 0
