0 mol 43 unq 0 iso 0 dist 8.47617 8.99509 5.06502 17.2393 9.74445 13.964 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 8.47617 5.73331 6.45462 17.2393 9.74445 15.3221 numMergedOcc 0
2 mol 43 unq 2 iso 0 dist 8.47617 8.48694 10.5986 17.2393 9.74445 17.4077 numMergedOcc 0
3 mol 89 unq 0 iso 0 dist 5.25504 7.84991 6.88931 6.28243 6.36021 12.5644 numMergedOcc 0
4 mol 110 unq 0 iso 0 dist 8.93253 8.1306 4.56913 9.6516 7.21229 5.25492 numMergedOcc 0
5 mol 110 unq 1 iso 0 dist 8.1306 8.93253 4.56913 9.6516 5.25492 7.21229 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 6.53153 6.29975 6.69554 6.6767 9.48243 11.0972 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 6.53153 8.29673 6.761 6.6767 9.48243 14.1743 numMergedOcc 0
8 mol 152 unq 0 iso 0 dist 9.0847 9.37459 5.42328 17.3026 9.10619 13.6844 numMergedOcc 0
9 mol 152 unq 1 iso 0 dist 9.0847 6.00061 6.4896 17.3026 9.10619 15.1988 numMergedOcc 0
10 mol 152 unq 2 iso 0 dist 9.0847 8.33302 10.2431 17.3026 9.10619 17.1564 numMergedOcc 0
11 mol 152 unq 3 iso 0 dist 6.00061 9.37459 5.54906 4.14546 9.74498 12.7397 numMergedOcc 0
12 mol 152 unq 4 iso 0 dist 6.00061 9.0847 6.4896 4.14546 9.74498 13.0082 numMergedOcc 0
13 mol 152 unq 5 iso 0 dist 6.00061 8.33302 5.68553 4.14546 9.74498 11.4746 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 7.23126 4.97115 10.2747 13.7733 6.76923 15.6936 numMergedOcc 0
15 mol 196 unq 1 iso 0 dist 7.23126 9.45804 11.8114 13.7733 6.76923 16.7437 numMergedOcc 0
16 mol 196 unq 2 iso 0 dist 7.23126 9.8486 10.1707 13.7733 6.76923 15.2969 numMergedOcc 0
17 mol 213 unq 0 iso 0 dist 8.48081 7.22234 5.45334 11.6202 4.58599 9.94786 numMergedOcc 0
18 mol 213 unq 1 iso 0 dist 8.48081 7.22234 5.45334 15.8119 8.78568 13.5801 numMergedOcc 0
19 mol 238 unq 0 iso 0 dist 8.39522 5.99187 14.0328 11.1968 9.75174 14.7827 numMergedOcc 0
20 mol 238 unq 1 iso 0 dist 8.39522 9.93378 15.8898 11.1968 9.75174 12.6582 numMergedOcc 0
21 mol 259 unq 0 iso 0 dist 5.29682 6.20344 4.69778 4.98212 6.77279 9.58006 numMergedOcc 0
22 mol 259 unq 1 iso 0 dist 6.20344 5.29682 4.69778 4.98212 9.58006 6.77279 numMergedOcc 0
23 mol 265 unq 0 iso 0 dist 7.83102 8.59825 9.87519 10.5845 8.1498 16.026 numMergedOcc 0
