0 mol 16 unq 0 iso 0 dist 6.68517 5.65481 4.7319 5.1333 6.72833 6.51133 11.0264 5.40044 6.28033 9.9153 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 8.94828 14.2406 7.57578 6.84017 6.16347 9.34396 13.4188 4.96681 9.22151 10.2461 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 8.94828 14.2406 7.57578 15.5398 7.92503 6.11127 13.4188 4.96681 9.22151 8.00738 numMergedOcc 0
3 mol 25 unq 2 iso 0 dist 8.94828 15.6642 7.17969 6.84017 6.16347 10.8498 13.4188 4.96681 6.22122 10.2461 numMergedOcc 0
4 mol 25 unq 3 iso 0 dist 8.94828 15.6642 7.17969 15.5398 7.92503 5.30154 13.4188 4.96681 6.22122 8.00738 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 8.06275 5.5249 8.80331 5.33298 8.95682 6.18002 8.34858 5.90113 9.17086 11.9521 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 8.90024 13.9129 8.80331 13.2914 8.95682 6.18002 13.9217 5.90113 9.17086 11.9521 numMergedOcc 0
7 mol 72 unq 0 iso 0 dist 9.43143 16.2349 9.96708 11.9655 9.27838 11.6378 19.7927 11.6369 6.7212 16.4419 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.50575 6.68557 5.11551 13.4067 6.92026 6.77806 9.17664 5.47689 6.55511 10.0041 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 8.43116 4.96719 5.11551 5.19545 6.92026 6.77806 9.18913 5.47689 6.55511 10.0041 numMergedOcc 0
10 mol 115 unq 2 iso 0 dist 6.23645 4.96719 7.11972 5.19545 5.88249 6.77806 9.18913 6.00348 6.55511 10.0041 numMergedOcc 0
11 mol 115 unq 3 iso 0 dist 6.23645 6.47836 6.90986 5.19545 5.88249 5.31484 9.60261 5.14332 8.46684 5.9575 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 5.79157 14.1608 9.71307 12.2847 9.94764 5.29786 16.096 12.0971 7.27598 9.95528 numMergedOcc 0
13 mol 181 unq 0 iso 0 dist 9.74465 8.42326 8.03334 5.03999 6.46704 4.43096 15.6915 14.0828 8.90247 11.3392 numMergedOcc 0
14 mol 181 unq 1 iso 0 dist 9.74465 8.42326 8.03334 13.5125 6.59025 8.04639 15.6915 14.0828 8.90247 13.656 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 8.77347 6.05728 7.54065 10.0244 8.73217 11.7429 10.4734 8.61343 5.16813 12.0848 numMergedOcc 0
16 mol 231 unq 0 iso 0 dist 6.02527 6.68357 7.37839 6.46271 7.79066 9.0443 13.2048 10.613 8.91036 10.7108 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 8.82778 11.4665 6.16342 15.4125 8.84636 4.30299 9.20248 4.77446 6.83046 10.3104 numMergedOcc 0
