0 mol 8 unq 0 iso 0 dist 7.46102 9.47227 6.31827 3.69663 4.92734 6.26138 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 7.46102 9.91301 8.4069 3.69663 4.92734 6.57999 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 9.47227 7.46102 6.31827 3.69663 6.26138 4.92734 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 9.47227 9.91301 5.27819 3.69663 6.26138 6.57999 numMergedOcc 0
4 mol 8 unq 4 iso 0 dist 9.91301 7.46102 8.4069 11.375 6.4754 11.9453 numMergedOcc 0
5 mol 8 unq 5 iso 0 dist 9.91301 7.46102 8.4069 3.69663 6.57999 4.92734 numMergedOcc 0
6 mol 8 unq 6 iso 0 dist 9.91301 9.47227 5.27819 11.375 6.4754 11.4233 numMergedOcc 0
7 mol 8 unq 7 iso 0 dist 9.91301 9.47227 5.27819 3.69663 6.57999 6.26138 numMergedOcc 0
8 mol 25 unq 0 iso 0 dist 8.88413 9.87281 10.8648 5.30126 6.22122 12.8488 numMergedOcc 0
9 mol 25 unq 1 iso 0 dist 8.88413 7.63928 10.2779 5.30126 6.22122 10.5677 numMergedOcc 0
10 mol 69 unq 0 iso 0 dist 9.8809 5.47319 8.99811 8.50061 7.62791 11.7488 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 6.40546 7.91337 8.61848 9.90172 7.85527 12.9497 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 5.63005 8.82535 9.93385 11.5865 8.62648 18.4374 numMergedOcc 0
13 mol 119 unq 2 iso 0 dist 5.63005 6.18763 9.93257 11.5865 8.62648 17.5132 numMergedOcc 0
14 mol 119 unq 3 iso 0 dist 5.63005 8.44385 4.85907 11.5865 8.62648 11.5266 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 9.60411 9.92932 5.49782 13.5049 7.27598 12.3933 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 5.41292 8.3337 6.75702 6.1839 8.76932 11.1497 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 6.9398 7.0843 6.17651 6.7488 4.851 9.89546 numMergedOcc 0
18 mol 218 unq 1 iso 0 dist 6.9398 7.73315 5.61978 6.7488 4.851 9.66527 numMergedOcc 0
19 mol 219 unq 0 iso 0 dist 4.87446 7.49235 6.74494 6.28221 6.8424 12.5982 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 8.39002 8.46129 5.0744 4.61429 9.73411 10.1632 numMergedOcc 0
21 mol 224 unq 1 iso 0 dist 8.39002 8.46129 5.0744 11.1139 7.07564 12.0295 numMergedOcc 0
22 mol 224 unq 2 iso 0 dist 8.39002 9.2053 5.60236 4.61429 9.73411 7.75485 numMergedOcc 0
23 mol 224 unq 3 iso 0 dist 8.39002 9.2053 5.60236 11.1139 7.07564 9.11052 numMergedOcc 0
24 mol 224 unq 4 iso 0 dist 9.2053 8.39002 5.60236 4.61429 7.75485 9.73411 numMergedOcc 0
25 mol 224 unq 5 iso 0 dist 9.2053 8.39002 5.60236 11.1139 9.11052 7.07564 numMergedOcc 0
26 mol 224 unq 6 iso 0 dist 9.2053 8.46129 6.91102 4.61429 7.75485 10.1632 numMergedOcc 0
27 mol 224 unq 7 iso 0 dist 9.2053 8.46129 6.91102 11.1139 9.11052 12.0295 numMergedOcc 0
28 mol 232 unq 0 iso 0 dist 7.70279 9.29752 6.56633 5.18593 8.89211 13.0468 numMergedOcc 0
29 mol 251 unq 0 iso 0 dist 9.228 7.4878 6.46034 6.23285 8.8487 11.2696 numMergedOcc 0
30 mol 251 unq 1 iso 0 dist 7.4878 9.228 6.46034 6.68895 7.54763 12.8789 numMergedOcc 0
31 mol 274 unq 0 iso 0 dist 8.49076 9.09967 12.8986 7.64336 6.36173 11.8362 numMergedOcc 0
32 mol 274 unq 1 iso 0 dist 9.52894 6.55855 6.828 9.82234 8.71129 12.6563 numMergedOcc 0
33 mol 277 unq 0 iso 0 dist 7.88897 8.11838 5.44531 5.24499 7.07459 9.02254 numMergedOcc 0
