0 mol 25 unq 0 iso 0 dist 9.80157 6.94361 8.41008 6.7276 8.23292 6.32132 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 6.26613 9.10695 7.57227 6.5074 8.62669 6.31514 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 5.04007 5.3778 8.00814 5.82571 6.87176 8.13782 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 5.04007 5.3778 8.00814 8.48982 7.45675 5.57159 numMergedOcc 0
4 mol 68 unq 2 iso 0 dist 7.81025 6.04463 8.00814 5.4779 6.87176 8.13782 numMergedOcc 0
5 mol 68 unq 3 iso 0 dist 7.81025 6.04463 8.00814 6.38698 7.45675 5.57159 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 9.26301 14.683 5.66196 15.8173 9.24515 6.4595 numMergedOcc 0
7 mol 122 unq 0 iso 0 dist 8.50192 10.708 6.78551 5.29937 9.69673 8.69043 numMergedOcc 0
8 mol 132 unq 0 iso 0 dist 8.97036 10.6251 9.10144 13.8837 6.495 10.3663 numMergedOcc 0
9 mol 132 unq 1 iso 0 dist 8.97036 10.6251 9.10144 14.8844 9.43748 9.16496 numMergedOcc 0
10 mol 198 unq 0 iso 0 dist 8.35833 7.7802 8.74957 5.85344 7.24395 7.19115 numMergedOcc 0
11 mol 198 unq 1 iso 0 dist 8.35833 14.3237 7.91967 5.85344 7.24395 9.88249 numMergedOcc 0
12 mol 198 unq 2 iso 0 dist 8.35833 10.1086 7.83611 5.85344 7.24395 12.0915 numMergedOcc 0
13 mol 212 unq 0 iso 0 dist 8.53152 5.3488 8.02266 6.05846 9.1384 5.13112 numMergedOcc 0
14 mol 212 unq 1 iso 0 dist 8.53152 5.3488 8.02266 5.19318 7.87125 7.30329 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 7.7874 14.8232 9.66533 4.71355 7.77535 11.4345 numMergedOcc 0
16 mol 214 unq 1 iso 0 dist 8.67902 6.11845 5.12798 9.17261 8.47248 4.16289 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 9.98041 8.316 6.6238 6.00315 6.96379 4.53603 numMergedOcc 0
