0 mol 1 unq 0 iso 0 dist 6.35771 9.43252 8.26708 11.9399 7.27254 6.27888 18.0744 12.7486 12.8272 6.86701 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.35771 10.7006 6.09918 11.9399 7.27254 4.50502 18.0744 12.7486 10.488 6.86701 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 6.66645 12.1978 5.72491 12.0608 8.15894 7.12508 11.5381 10.2446 10.5461 9.87885 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 6.66645 12.1978 5.72491 12.0608 8.15894 7.12508 9.62914 5.44992 7.10621 6.1206 numMergedOcc 0
4 mol 7 unq 2 iso 0 dist 6.66645 4.78012 7.88043 12.0608 8.15894 12.8323 11.5381 10.2446 8.41585 9.87885 numMergedOcc 0
5 mol 7 unq 3 iso 0 dist 6.66645 4.78012 7.88043 12.0608 8.15894 12.8323 9.62914 5.44992 12.2333 6.1206 numMergedOcc 0
6 mol 7 unq 4 iso 0 dist 5.22017 4.78012 8.80762 12.0608 8.45544 12.8323 11.5381 12.3097 8.41585 9.87885 numMergedOcc 0
7 mol 7 unq 5 iso 0 dist 5.22017 4.78012 8.80762 12.0608 8.45544 12.8323 9.62914 4.74523 12.2333 6.1206 numMergedOcc 0
8 mol 43 unq 0 iso 0 dist 9.32155 7.23774 8.44903 10.4149 7.15901 4.96926 14.9909 7.05402 10.5523 6.6263 numMergedOcc 0
9 mol 43 unq 1 iso 0 dist 9.32155 7.23774 8.44903 10.4149 7.15901 4.96926 9.16827 5.48048 5.73819 6.75943 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 9.57633 6.58144 7.27383 7.43516 6.87028 4.00553 7.04193 7.40296 10.3988 9.97769 numMergedOcc 0
11 mol 58 unq 1 iso 0 dist 9.57633 6.58144 7.27383 7.43516 6.87028 4.00553 10.365 5.89202 11.221 9.32706 numMergedOcc 0
12 mol 58 unq 2 iso 0 dist 9.57633 6.58144 7.27383 7.43516 6.87028 4.00553 7.15486 6.37648 6.64012 9.08221 numMergedOcc 0
13 mol 92 unq 0 iso 0 dist 8.99661 5.41023 6.61823 4.57682 6.98037 5.31547 8.22406 7.24315 9.64443 9.36001 numMergedOcc 0
14 mol 92 unq 1 iso 0 dist 8.99661 5.41023 6.61823 8.67704 6.9223 4.3481 13.6801 6.08245 9.33898 7.06939 numMergedOcc 0
15 mol 112 unq 0 iso 0 dist 9.67948 11.4909 6.43433 6.74766 4.99604 6.95317 15.3651 10.1567 11.5121 9.02706 numMergedOcc 0
16 mol 112 unq 1 iso 0 dist 9.67948 11.4909 6.43433 6.74766 4.99604 6.95317 15.1697 8.56707 7.71338 8.47988 numMergedOcc 0
17 mol 112 unq 2 iso 0 dist 9.67948 11.4909 6.43433 12.703 7.44041 6.75738 20.9873 12.6695 11.8312 9.05166 numMergedOcc 0
18 mol 112 unq 3 iso 0 dist 9.67948 13.1737 9.92283 6.74766 4.99604 10.9279 15.3651 10.1567 16.5915 9.02706 numMergedOcc 0
19 mol 112 unq 4 iso 0 dist 9.67948 13.1737 9.92283 6.74766 4.99604 10.9279 15.1697 8.56707 12.603 8.47988 numMergedOcc 0
20 mol 112 unq 5 iso 0 dist 9.67948 13.1737 9.92283 12.703 7.44041 5.43385 20.9873 12.6695 11.438 9.05166 numMergedOcc 0
21 mol 112 unq 6 iso 0 dist 6.55773 10.3209 6.43433 3.50778 4.99604 6.95317 10.0727 10.1567 11.5121 9.02706 numMergedOcc 0
22 mol 112 unq 7 iso 0 dist 6.55773 10.3209 6.43433 3.50778 4.99604 6.95317 10.9647 8.56707 7.71338 8.47988 numMergedOcc 0
23 mol 112 unq 8 iso 0 dist 6.55773 10.3209 6.43433 12.7907 7.44041 6.75738 19.1937 12.6695 11.8312 9.05166 numMergedOcc 0
24 mol 112 unq 9 iso 0 dist 6.55773 13.9635 9.92283 3.50778 4.99604 10.9279 10.0727 10.1567 16.5915 9.02706 numMergedOcc 0
25 mol 112 unq 10 iso 0 dist 6.55773 13.9635 9.92283 3.50778 4.99604 10.9279 10.9647 8.56707 12.603 8.47988 numMergedOcc 0
26 mol 112 unq 11 iso 0 dist 6.55773 13.9635 9.92283 12.7907 7.44041 5.43385 19.1937 12.6695 11.438 9.05166 numMergedOcc 0
27 mol 119 unq 0 iso 0 dist 9.89116 9.70986 7.77116 13.4766 9.57341 9.68677 14.5254 13.52 16.4353 8.95212 numMergedOcc 0
28 mol 119 unq 1 iso 0 dist 9.89116 9.70986 7.77116 13.4766 9.57341 9.68677 13.3176 4.99056 10.3704 6.99446 numMergedOcc 0
29 mol 119 unq 2 iso 0 dist 9.89116 9.70986 7.77116 13.4766 9.57341 9.68677 8.59784 3.78311 8.73993 7.64052 numMergedOcc 0
30 mol 188 unq 0 iso 0 dist 7.98533 6.33907 8.57261 8.40761 7.79115 9.71636 11.6748 5.48276 13.353 7.88013 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 6.52129 5.65307 5.52379 6.10342 6.53286 4.48415 14.66 11.0349 11.5794 9.12776 numMergedOcc 0
32 mol 238 unq 1 iso 0 dist 6.52129 5.65307 5.52379 6.10342 6.53286 4.48415 7.80166 10.7551 12.2442 9.72188 numMergedOcc 0
33 mol 252 unq 0 iso 0 dist 9.00798 6.57025 6.11473 7.92795 9.39658 5.6214 14.9069 13.9054 10.5136 7.15764 numMergedOcc 0
