0 mol 26 unq 0 iso 0 dist 9.03539 8.36742 12.6238 10.4631 7.22361 9.82851 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.03539 8.10028 15.703 10.4631 7.22361 15.3948 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 6.76514 6.93709 8.03182 5.31805 4.62858 10.3586 numMergedOcc 0
3 mol 45 unq 0 iso 0 dist 7.62709 8.55903 3.82801 7.29857 5.55096 9.09185 numMergedOcc 0
4 mol 45 unq 1 iso 0 dist 7.61402 7.55443 6.76899 5.45932 7.21995 11.1846 numMergedOcc 0
5 mol 45 unq 2 iso 0 dist 7.61402 7.55443 6.76899 8.19237 9.62637 13.1456 numMergedOcc 0
6 mol 45 unq 3 iso 0 dist 8.11293 7.55443 8.98411 5.45932 7.70625 11.1846 numMergedOcc 0
7 mol 45 unq 4 iso 0 dist 8.11293 7.55443 8.98411 8.19237 6.01423 13.1456 numMergedOcc 0
8 mol 54 unq 0 iso 0 dist 8.41365 9.63616 10.2702 5.01159 6.30987 5.27979 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 8.10681 9.50762 11.6359 6.69013 4.25566 10.6112 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 8.10681 9.50762 11.6359 12.7134 7.31037 16.1469 numMergedOcc 0
11 mol 141 unq 2 iso 0 dist 8.10681 7.57472 9.08526 6.69013 4.25566 4.92382 numMergedOcc 0
12 mol 141 unq 3 iso 0 dist 8.10681 7.57472 9.08526 12.7134 7.31037 8.38715 numMergedOcc 0
13 mol 141 unq 4 iso 0 dist 4.69823 9.50762 5.30105 6.69013 6.63171 10.6112 numMergedOcc 0
14 mol 141 unq 5 iso 0 dist 4.69823 7.57472 8.96466 6.69013 6.63171 4.92382 numMergedOcc 0
15 mol 175 unq 0 iso 0 dist 9.21278 7.10869 6.54263 5.81919 9.19117 4.51777 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 9.7281 8.07518 4.22401 12.6646 8.9289 12.1137 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 9.7281 7.39733 7.66761 12.6646 8.9289 12.0951 numMergedOcc 0
18 mol 193 unq 0 iso 0 dist 8.52642 6.10013 9.95269 9.7127 7.60625 11.7052 numMergedOcc 0
19 mol 232 unq 0 iso 0 dist 8.94854 4.76819 9.20175 13.3182 7.10413 15.4302 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 6.19514 5.90826 3.94343 13.5391 8.09718 10.5377 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 6.19514 5.90826 3.94343 9.75263 6.73446 9.78013 numMergedOcc 0
22 mol 284 unq 0 iso 0 dist 8.6173 6.61811 10.1727 4.47263 6.61376 9.75958 numMergedOcc 0
23 mol 291 unq 0 iso 0 dist 6.29284 7.02207 3.70474 4.23643 6.27039 5.40381 numMergedOcc 0
