0 mol 8 unq 0 iso 0 dist 9.52805 5.89089 5.12111 4.16129 6.96907 5.68648 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 9.52805 9.78638 10.7532 4.16129 6.96907 11.8129 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 9.23092 8.75995 8.38443 7.54957 8.03504 6.65254 numMergedOcc 0
3 mol 55 unq 1 iso 0 dist 9.23092 6.0933 7.60951 7.54957 8.03504 8.97965 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 8.1123 8.74231 15.2214 4.24825 9.56188 10.5679 numMergedOcc 0
5 mol 96 unq 0 iso 0 dist 6.29224 8.92287 6.21391 7.13132 8.71026 14.2413 numMergedOcc 0
6 mol 100 unq 0 iso 0 dist 5.72842 7.02792 7.68675 6.69867 8.09751 13.081 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 5.09285 7.91231 4.24853 13.76 8.75093 8.14429 numMergedOcc 0
8 mol 171 unq 0 iso 0 dist 4.46397 8.68992 9.02044 4.53761 4.59484 12.2832 numMergedOcc 0
9 mol 222 unq 0 iso 0 dist 8.27605 8.81925 11.2593 4.56851 5.17916 8.86173 numMergedOcc 0
10 mol 229 unq 0 iso 0 dist 7.68999 9.68636 5.65373 4.44794 6.86281 11.2048 numMergedOcc 0
11 mol 229 unq 1 iso 0 dist 7.68999 7.81415 6.23084 4.44794 6.86281 8.68804 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 9.73405 9.94587 17.5803 12.7026 7.75366 20.5168 numMergedOcc 0
13 mol 241 unq 0 iso 0 dist 8.0779 5.40961 10.0113 5.88645 6.54678 10.7463 numMergedOcc 0
14 mol 241 unq 1 iso 0 dist 8.67571 5.57621 10.0597 4.84723 8.89435 7.73213 numMergedOcc 0
15 mol 271 unq 0 iso 0 dist 7.88092 7.59727 5.31774 6.04262 5.76281 9.42899 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 9.39145 6.38062 11.3986 4.33589 9.24592 8.19169 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 9.39145 6.38062 11.3986 4.33589 9.24592 8.19169 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 9.39145 6.38062 11.3986 4.33589 9.24592 8.19169 numMergedOcc 0
19 mol 294 unq 0 iso 0 dist 9.83069 5.71661 13.8637 6.49126 8.46311 9.97601 numMergedOcc 0
20 mol 294 unq 1 iso 0 dist 9.83069 8.98536 18.0966 6.49126 8.46311 14.0967 numMergedOcc 0
