0 mol 28 unq 0 iso 0 dist 7.96846 6.69917 13.5709 13.6284 20.1365 9.00593 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.63128 8.64844 12.7696 13.6749 19.1415 7.27883 numMergedOcc 0
2 mol 42 unq 0 iso 0 dist 9.36981 6.59566 12.3405 6.02246 15.1036 9.77392 numMergedOcc 0
3 mol 42 unq 1 iso 0 dist 6.64897 5.96747 3.24135 5.84086 11.2178 9.77392 numMergedOcc 0
4 mol 44 unq 0 iso 0 dist 7.89468 5.06773 11.6185 5.57404 13.0497 7.03812 numMergedOcc 0
5 mol 44 unq 1 iso 0 dist 8.13585 5.06773 5.05253 5.57404 11.5961 7.03812 numMergedOcc 0
6 mol 44 unq 2 iso 0 dist 9.84064 8.2444 5.05253 7.08048 11.5961 7.03812 numMergedOcc 0
7 mol 44 unq 3 iso 0 dist 8.44721 5.06773 7.95554 5.57404 7.55822 7.03812 numMergedOcc 0
8 mol 44 unq 4 iso 0 dist 5.31062 8.2444 7.95554 7.08048 7.55822 7.03812 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 6.75545 7.65992 12.2139 4.11905 9.12636 5.74389 numMergedOcc 0
10 mol 68 unq 1 iso 0 dist 8.99095 7.65992 12.213 4.11905 11.0117 5.74389 numMergedOcc 0
11 mol 71 unq 0 iso 0 dist 6.01135 8.87417 11.197 13.2306 17.4066 8.67545 numMergedOcc 0
12 mol 90 unq 0 iso 0 dist 7.10895 6.64347 8.07925 3.88931 10.4685 9.99316 numMergedOcc 0
13 mol 151 unq 0 iso 0 dist 5.37884 8.40211 5.04333 10.2163 9.75147 5.87912 numMergedOcc 0
14 mol 151 unq 1 iso 0 dist 5.37884 8.40211 5.04333 7.9137 8.29457 7.06678 numMergedOcc 0
15 mol 151 unq 2 iso 0 dist 6.24917 8.24746 5.04333 10.3952 9.75147 5.87912 numMergedOcc 0
16 mol 151 unq 3 iso 0 dist 6.24917 8.24746 5.04333 4.83603 8.29457 7.06678 numMergedOcc 0
17 mol 151 unq 4 iso 0 dist 7.64435 8.40211 4.87853 10.2163 8.88853 5.87912 numMergedOcc 0
18 mol 151 unq 5 iso 0 dist 7.64435 8.40211 4.87853 7.9137 10.6325 7.06678 numMergedOcc 0
19 mol 176 unq 0 iso 0 dist 8.44087 7.2799 6.19655 7.04396 9.7804 8.25343 numMergedOcc 0
20 mol 176 unq 1 iso 0 dist 8.44087 7.2799 6.19655 10.6032 10.4322 8.86094 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 8.22461 7.04167 3.84531 11.6918 13.2838 9.47421 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.32681 7.2551 7.30503 3.93775 5.56721 5.70326 numMergedOcc 0
23 mol 294 unq 0 iso 0 dist 6.81999 9.99345 12.4505 9.47753 15.5099 9.2542 numMergedOcc 0
