0 mol 62 unq 0 iso 0 dist 4.89196 6.7153 8.91572 8.33049 8.84323 5.56678 numMergedOcc 0
1 mol 90 unq 0 iso 0 dist 6.88603 11.8749 8.3399 4.5896 9.16721 14.696 numMergedOcc 0
2 mol 113 unq 0 iso 0 dist 8.94447 11.7007 8.55666 12.8097 5.44714 5.68158 numMergedOcc 0
3 mol 113 unq 1 iso 0 dist 8.94447 9.26549 8.45284 12.8097 5.44714 7.62483 numMergedOcc 0
4 mol 113 unq 2 iso 0 dist 8.94447 12.6498 7.77845 12.8097 5.44714 12.0928 numMergedOcc 0
5 mol 113 unq 3 iso 0 dist 8.94447 18.0659 9.43828 12.8097 5.44714 5.9573 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 9.6785 13.853 9.31512 4.73128 9.78437 10.6057 numMergedOcc 0
7 mol 114 unq 1 iso 0 dist 9.6785 5.5081 8.40088 4.73128 9.78437 6.20538 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 9.55297 5.41269 5.83972 7.15424 7.74744 4.38796 numMergedOcc 0
9 mol 197 unq 0 iso 0 dist 6.58245 7.6839 9.47487 11.5081 8.32685 16.7164 numMergedOcc 0
10 mol 197 unq 1 iso 0 dist 6.58245 7.6839 9.47487 11.8158 6.74777 16.2207 numMergedOcc 0
11 mol 197 unq 2 iso 0 dist 6.58245 7.6839 9.47487 14.0335 9.62514 18.5581 numMergedOcc 0
12 mol 212 unq 0 iso 0 dist 6.11919 7.19605 6.80916 5.23162 9.15316 12.2003 numMergedOcc 0
13 mol 233 unq 0 iso 0 dist 5.34745 8.39255 9.13657 3.73772 7.83363 6.03685 numMergedOcc 0
14 mol 233 unq 1 iso 0 dist 7.99897 6.69492 9.13657 10.5268 7.83363 6.03685 numMergedOcc 0
15 mol 233 unq 2 iso 0 dist 8.98366 15.1659 9.13657 14.0794 7.83363 6.03685 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 6.89216 6.24744 6.21984 4.79969 9.88122 5.8014 numMergedOcc 0
17 mol 264 unq 0 iso 0 dist 8.75957 11.2974 6.61098 10.8606 6.21206 6.06394 numMergedOcc 0
18 mol 264 unq 1 iso 0 dist 8.75957 14.3662 6.25794 10.8606 6.21206 6.73127 numMergedOcc 0
