0 mol 41 unq 0 iso 0 dist 6.68599 4.29713 6.02913 10.7817 7.89705 7.56029 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 7.65981 6.68114 8.3816 4.73199 8.72552 11.1826 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.23755 7.10218 4.93697 7.65955 5.14178 5.17145 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 6.88956 5.62245 6.86277 10.049 9.39702 13.3692 numMergedOcc 0
4 mol 128 unq 0 iso 0 dist 9.82711 6.6014 7.90985 9.4486 9.31019 9.84079 numMergedOcc 0
5 mol 128 unq 1 iso 0 dist 5.96435 8.88633 7.90985 5.85715 9.31019 9.84079 numMergedOcc 0
6 mol 128 unq 2 iso 0 dist 7.94925 6.78833 9.41812 5.6183 7.50206 9.12084 numMergedOcc 0
7 mol 128 unq 3 iso 0 dist 7.94925 6.78833 9.41812 9.00257 6.4028 13.4853 numMergedOcc 0
8 mol 204 unq 0 iso 0 dist 6.58174 7.59666 5.9546 14.2948 9.42862 15.1549 numMergedOcc 0
9 mol 204 unq 1 iso 0 dist 6.58174 6.51936 5.9943 14.2948 9.42862 13.5375 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 9.292 9.94292 4.86533 7.37565 9.87314 13.0564 numMergedOcc 0
11 mol 210 unq 1 iso 0 dist 9.292 9.94292 4.86533 5.35986 9.05206 9.14831 numMergedOcc 0
12 mol 214 unq 0 iso 0 dist 7.24175 6.28826 5.77142 14.3161 8.67237 12.8162 numMergedOcc 0
13 mol 214 unq 1 iso 0 dist 7.24175 6.28826 5.77142 8.07711 7.49436 11.5929 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 8.49961 9.77592 10.87 5.39451 9.36997 11.4495 numMergedOcc 0
15 mol 239 unq 1 iso 0 dist 8.49961 9.77592 10.87 11.0724 9.97907 17.8309 numMergedOcc 0
16 mol 239 unq 2 iso 0 dist 8.49961 9.77592 10.87 17.1388 8.83751 16.7651 numMergedOcc 0
17 mol 239 unq 3 iso 0 dist 8.49961 9.77592 10.87 16.0868 8.77688 19.4478 numMergedOcc 0
18 mol 240 unq 0 iso 0 dist 7.84314 7.78879 5.79131 5.28189 9.30056 11.9487 numMergedOcc 0
19 mol 250 unq 0 iso 0 dist 9.79531 8.43058 5.17779 5.92955 5.43238 6.93875 numMergedOcc 0
20 mol 250 unq 1 iso 0 dist 5.97672 8.51613 5.16962 9.35239 9.48115 14.3379 numMergedOcc 0
