0 mol 76 unq 0 iso 0 dist 9.33989 8.6411 5.70125 11.9403 7.46657 12.0091 numMergedOcc 0
1 mol 76 unq 1 iso 0 dist 8.57953 8.94956 5.70125 9.03147 7.46657 12.0091 numMergedOcc 0
2 mol 117 unq 0 iso 0 dist 7.82249 8.78982 5.13173 6.7814 9.32858 7.20326 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 5.84909 8.9344 5.28979 5.36939 9.1146 9.65709 numMergedOcc 0
4 mol 155 unq 0 iso 0 dist 8.02356 8.02593 6.6805 5.01007 8.57712 7.39644 numMergedOcc 0
5 mol 163 unq 0 iso 0 dist 9.24754 8.70104 13.3436 4.12904 8.32426 12.4589 numMergedOcc 0
6 mol 181 unq 0 iso 0 dist 5.13534 5.83596 5.20775 4.3226 7.7544 4.93785 numMergedOcc 0
7 mol 185 unq 0 iso 0 dist 5.7065 8.60027 7.04364 12.0971 8.8978 15.7183 numMergedOcc 0
8 mol 185 unq 1 iso 0 dist 5.7065 8.60027 7.04364 4.53126 5.03193 11.1239 numMergedOcc 0
9 mol 210 unq 0 iso 0 dist 5.70065 6.87234 6.86988 3.84723 6.13878 10.1086 numMergedOcc 0
10 mol 210 unq 1 iso 0 dist 5.70065 8.72017 10.1915 3.84723 6.13878 12.1564 numMergedOcc 0
11 mol 236 unq 0 iso 0 dist 9.51001 6.98151 4.71339 16.4752 9.44496 10.6445 numMergedOcc 0
12 mol 236 unq 1 iso 0 dist 9.51001 6.98151 4.71339 4.15973 7.87233 5.34718 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 4.53228 5.66792 4.74711 8.37622 7.78671 11.4476 numMergedOcc 0
