0 mol 11 unq 0 iso 0 dist 6.12043 9.88519 6.24549 10.6191 9.88198 15.0773 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 5.44478 7.4036 4.40652 7.00079 8.18296 5.76024 numMergedOcc 0
2 mol 12 unq 1 iso 0 dist 5.44478 7.4036 4.40652 6.50215 7.99569 7.92714 numMergedOcc 0
3 mol 65 unq 0 iso 0 dist 9.1487 8.58416 10.8649 4.91428 8.54555 5.94206 numMergedOcc 0
4 mol 65 unq 1 iso 0 dist 9.1487 8.58416 10.8649 7.66509 7.0386 10.909 numMergedOcc 0
5 mol 124 unq 0 iso 0 dist 6.31232 7.55095 5.34732 12.6015 9.18949 14.4228 numMergedOcc 0
6 mol 125 unq 0 iso 0 dist 4.81596 8.6317 6.22139 6.24872 7.00113 6.11502 numMergedOcc 0
7 mol 125 unq 1 iso 0 dist 4.81596 8.6317 6.22139 10.4668 9.85979 6.33431 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 8.60157 9.92375 13.7802 6.57631 6.86997 15.6733 numMergedOcc 0
9 mol 148 unq 1 iso 0 dist 8.60157 9.92375 13.7802 8.40891 7.46919 15.6971 numMergedOcc 0
10 mol 148 unq 2 iso 0 dist 8.60157 9.92375 13.7802 11.7674 8.24581 19.377 numMergedOcc 0
11 mol 158 unq 0 iso 0 dist 6.45502 9.58371 5.97811 7.33177 8.07946 13.1523 numMergedOcc 0
12 mol 158 unq 1 iso 0 dist 8.66056 7.13199 5.97811 11.4363 8.07946 13.1523 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 9.66591 6.43099 7.12407 9.42295 8.11292 11.2959 numMergedOcc 0
14 mol 162 unq 1 iso 0 dist 9.66591 9.35189 13.4924 9.42295 8.11292 17.1868 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 9.39563 5.11863 8.78943 12.9618 4.88303 10.95 numMergedOcc 0
16 mol 184 unq 1 iso 0 dist 7.51045 5.92785 8.78943 8.54538 4.88303 10.95 numMergedOcc 0
17 mol 247 unq 0 iso 0 dist 5.32075 6.76933 5.44215 6.25568 6.29945 8.45756 numMergedOcc 0
18 mol 284 unq 0 iso 0 dist 5.62295 5.61727 6.50962 8.51351 4.87349 7.34931 numMergedOcc 0
