0 mol 16 unq 0 iso 0 dist 8.62634 6.68517 6.05535 7.67331 9.24115 8.59049 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 7.96502 5.50504 6.32949 12.0885 10.2903 9.70415 numMergedOcc 0
2 mol 69 unq 0 iso 0 dist 8.32033 6.92837 13.1847 4.18064 12.2915 7.62791 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 8.78888 9.49626 9.44493 6.11663 10.1313 7.63663 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 8.06901 5.48831 5.86484 5.50284 11.9228 6.7212 numMergedOcc 0
5 mol 72 unq 1 iso 0 dist 8.06901 9.39178 8.82422 5.50284 11.9228 9.08821 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 9.93275 9.29446 9.54341 9.98366 8.08277 5.57265 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 9.93275 9.29446 9.54341 8.55415 14.0161 7.05258 numMergedOcc 0
8 mol 86 unq 0 iso 0 dist 8.45341 5.63037 9.69527 3.72385 12.1003 7.35763 numMergedOcc 0
9 mol 102 unq 0 iso 0 dist 7.90927 8.84131 9.9427 8.38008 11.9011 9.84673 numMergedOcc 0
10 mol 102 unq 1 iso 0 dist 6.7095 8.84131 7.49575 8.38008 11.8703 9.84673 numMergedOcc 0
11 mol 115 unq 0 iso 0 dist 9.18707 8.64107 5.74878 7.29402 10.4328 6.04412 numMergedOcc 0
12 mol 115 unq 1 iso 0 dist 5.91786 8.64107 7.09627 7.29402 9.95293 6.04412 numMergedOcc 0
13 mol 134 unq 0 iso 0 dist 6.7402 8.84656 8.44345 9.86688 10.5688 7.27598 numMergedOcc 0
14 mol 134 unq 1 iso 0 dist 6.7402 4.9155 7.46245 9.86688 10.5688 5.57904 numMergedOcc 0
15 mol 139 unq 0 iso 0 dist 7.83417 5.11962 4.78289 3.873 11.6146 8.32294 numMergedOcc 0
16 mol 209 unq 0 iso 0 dist 9.20752 5.92907 9.95971 11.0219 11.9796 6.14896 numMergedOcc 0
17 mol 209 unq 1 iso 0 dist 9.20752 5.92907 9.95971 13.6092 16.7346 9.12289 numMergedOcc 0
18 mol 232 unq 0 iso 0 dist 9.10154 7.57253 5.45696 4.97762 9.2737 9.95045 numMergedOcc 0
19 mol 261 unq 0 iso 0 dist 6.93654 9.80409 13.3163 13.665 17.9452 6.82526 numMergedOcc 0
20 mol 261 unq 1 iso 0 dist 9.66298 9.80409 13.6041 13.665 17.209 6.82526 numMergedOcc 0
21 mol 278 unq 0 iso 0 dist 7.74708 9.91518 4.69872 15.3461 12.3611 8.83775 numMergedOcc 0
22 mol 278 unq 1 iso 0 dist 6.03414 9.91518 8.66976 15.3461 16.7318 8.83775 numMergedOcc 0
23 mol 278 unq 2 iso 0 dist 9.82026 9.91518 17.1306 15.3461 24.508 8.83775 numMergedOcc 0
