0 mol 8 unq 0 iso 0 dist 7.58816 8.79328 4.92734 9.36227 3.69663 7.46102 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 7.58816 4.45895 6.26138 9.36227 3.69663 9.47227 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 7.58816 8.5845 6.57999 9.36227 3.69663 9.91301 numMergedOcc 0
3 mol 69 unq 0 iso 0 dist 9.62336 10.1382 7.62791 16.9446 8.50061 9.8809 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 6.40355 4.57694 5.56964 12.0927 13.4991 8.58841 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 8.27253 10.7421 7.85527 11.8884 9.90172 6.40546 numMergedOcc 0
6 mol 129 unq 0 iso 0 dist 9.66828 7.59962 6.23966 10.5788 8.56696 6.38163 numMergedOcc 0
7 mol 154 unq 0 iso 0 dist 6.59749 5.88662 8.34737 10.6788 7.19596 9.93555 numMergedOcc 0
8 mol 185 unq 0 iso 0 dist 7.55408 8.20407 6.89879 9.56016 8.59489 9.878 numMergedOcc 0
9 mol 185 unq 1 iso 0 dist 7.55408 8.20407 6.89879 10.1555 4.29924 9.21149 numMergedOcc 0
10 mol 185 unq 2 iso 0 dist 8.38127 4.83776 6.89879 7.92501 8.59489 9.878 numMergedOcc 0
11 mol 185 unq 3 iso 0 dist 8.38127 4.83776 6.89879 8.27418 4.29924 9.21149 numMergedOcc 0
12 mol 199 unq 0 iso 0 dist 9.61894 9.18139 9.30897 11.6714 4.98653 8.30443 numMergedOcc 0
13 mol 212 unq 0 iso 0 dist 8.85976 14.7053 9.47932 19.2375 12.1126 5.87223 numMergedOcc 0
14 mol 212 unq 1 iso 0 dist 8.85976 14.7053 9.47932 11.4337 4.95466 8.062 numMergedOcc 0
15 mol 212 unq 2 iso 0 dist 8.85976 14.7053 9.47932 18.4489 11.245 8.70011 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 7.43427 5.53181 4.851 8.61427 6.7488 6.9398 numMergedOcc 0
17 mol 218 unq 1 iso 0 dist 7.50841 5.02331 4.851 11.8424 6.7488 6.9398 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 9.18345 5.33567 6.06422 13.7774 6.21166 9.13537 numMergedOcc 0
19 mol 238 unq 1 iso 0 dist 5.83646 5.60375 4.87108 7.82564 5.12308 9.66555 numMergedOcc 0
20 mol 238 unq 2 iso 0 dist 5.83646 5.60375 4.87108 9.91136 4.29839 8.67205 numMergedOcc 0
21 mol 256 unq 0 iso 0 dist 8.88264 6.4717 5.98967 7.14598 4.19031 7.67598 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 9.80725 12.7699 8.57619 13.3981 8.46264 9.12507 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 4.88541 4.38226 9.07043 5.43053 4.55986 8.12852 numMergedOcc 0
24 mol 274 unq 0 iso 0 dist 7.03782 10.4747 8.71129 13.1221 9.82234 9.52894 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 7.91992 10.8591 7.07459 12.0244 5.24499 7.88897 numMergedOcc 0
