0 mol 2 unq 0 iso 0 dist 7.99162 6.38677 9.58976 15.1169 13.0675 9.57645 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 9.81637 4.95437 7.84983 12.4928 4.81926 9.56737 numMergedOcc 0
2 mol 89 unq 0 iso 0 dist 8.85873 11.2532 6.36021 15.2525 6.50464 9.58625 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 9.23803 5.20171 9.74643 11.1563 7 8.21889 numMergedOcc 0
4 mol 109 unq 1 iso 0 dist 9.23803 5.20171 9.74643 8.05028 6.94915 6.86702 numMergedOcc 0
5 mol 109 unq 2 iso 0 dist 8.05028 5.20171 6.86702 11.1563 8.40993 8.21889 numMergedOcc 0
6 mol 109 unq 3 iso 0 dist 8.05028 5.20171 6.86702 9.23803 6.94915 9.74643 numMergedOcc 0
7 mol 110 unq 0 iso 0 dist 9.9633 9.40358 7.21229 12.1631 4.56913 5.25492 numMergedOcc 0
8 mol 110 unq 1 iso 0 dist 7.77678 11.5698 5.25492 10.6355 4.56913 7.21229 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 6.99793 5.67441 7.25166 6.71345 11.6284 8.42445 numMergedOcc 0
10 mol 114 unq 1 iso 0 dist 6.71345 5.67441 8.42445 6.99793 11.6284 7.25166 numMergedOcc 0
11 mol 142 unq 0 iso 0 dist 8.86346 7.25495 7.57458 11.4335 7.81981 8.48413 numMergedOcc 0
12 mol 142 unq 1 iso 0 dist 4.93681 5.20379 7.57458 9.02916 7.81981 8.48413 numMergedOcc 0
13 mol 206 unq 0 iso 0 dist 5.82039 10.3181 8.31638 10.8077 5.18293 9.99185 numMergedOcc 0
14 mol 206 unq 1 iso 0 dist 5.82039 8.09615 9.72979 6.22964 7.08143 6.97859 numMergedOcc 0
15 mol 206 unq 2 iso 0 dist 6.22964 8.09615 6.97859 5.82039 7.08143 9.72979 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 5.60236 7.33514 9.71281 13.6806 12.1984 9.2433 numMergedOcc 0
17 mol 235 unq 1 iso 0 dist 9.03917 10.7399 9.71281 16.3162 12.1984 9.2433 numMergedOcc 0
18 mol 257 unq 0 iso 0 dist 6.26533 6.20948 8.69184 9.67549 5.74182 8.18901 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 9.07206 5.7123 6.28512 13.4534 5.57311 9.01085 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 8.53324 7.09461 9.02914 12.93 9.50605 8.57532 numMergedOcc 0
21 mol 277 unq 1 iso 0 dist 8.53324 7.09461 9.02914 7.23956 7.08227 6.90434 numMergedOcc 0
22 mol 277 unq 2 iso 0 dist 7.23956 7.09461 6.90434 12.93 12.7728 8.57532 numMergedOcc 0
23 mol 277 unq 3 iso 0 dist 7.23956 7.09461 6.90434 8.53324 7.08227 9.02914 numMergedOcc 0
24 mol 277 unq 4 iso 0 dist 8.66941 16.013 9.02914 17.0075 9.50605 8.57532 numMergedOcc 0
25 mol 277 unq 5 iso 0 dist 8.66941 16.013 9.02914 12.8481 7.08227 6.90434 numMergedOcc 0
