0 mol 111 unq 0 iso 0 dist 8.11813 7.40992 7.36025 11.9755 4.58626 9.33168 numMergedOcc 0
1 mol 126 unq 0 iso 0 dist 5.78493 6.26197 9.67741 7.25133 4.32945 9.93897 numMergedOcc 0
2 mol 133 unq 0 iso 0 dist 6.67937 5.16554 9.88156 11.4657 11.2135 8.43088 numMergedOcc 0
3 mol 141 unq 0 iso 0 dist 8.12558 7.38452 7.53168 10.5206 3.82773 7.83578 numMergedOcc 0
4 mol 165 unq 0 iso 0 dist 5.93144 9.78341 5.03758 12.0734 8.92393 5.5411 numMergedOcc 0
5 mol 176 unq 0 iso 0 dist 8.79752 5.22451 7.69241 13.0224 8.5262 9.2569 numMergedOcc 0
6 mol 176 unq 1 iso 0 dist 7.29985 5.22451 7.77962 13.0224 9.16728 9.2569 numMergedOcc 0
7 mol 176 unq 2 iso 0 dist 7.58281 5.22451 8.6431 13.0224 9.81633 9.2569 numMergedOcc 0
8 mol 183 unq 0 iso 0 dist 7.80268 6.08414 4.77438 12.7209 11.0234 8.74697 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 6.97766 8.42816 6.7279 8.39345 4.25519 8.51847 numMergedOcc 0
10 mol 253 unq 0 iso 0 dist 6.93942 8.79627 9.137 11.4455 7.64377 5.80702 numMergedOcc 0
11 mol 253 unq 1 iso 0 dist 9.05161 8.79627 8.0127 11.4455 4.87368 5.80702 numMergedOcc 0
12 mol 253 unq 2 iso 0 dist 9.31626 5.05272 9.137 9.58767 7.64377 5.80702 numMergedOcc 0
13 mol 253 unq 3 iso 0 dist 9.77366 5.05272 8.0127 9.58767 4.87368 5.80702 numMergedOcc 0
14 mol 284 unq 0 iso 0 dist 8.2236 15.479 8.2474 11.0108 4.93279 9.08764 numMergedOcc 0
15 mol 294 unq 0 iso 0 dist 7.94656 10.5231 7.75936 16.9189 14.5068 9.68579 numMergedOcc 0
