0 mol 7 unq 0 iso 0 dist 6.66645 9.60361 8.0744 12.1978 5.72491 9.67164 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.66645 9.60361 8.0744 4.78012 7.88043 5.99459 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.22017 9.60361 11.7002 4.78012 8.80762 5.99459 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 6.98291 6.04822 7.41888 6.32132 6.6492 7.52933 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 6.98291 7.72717 4.38027 6.32132 6.6492 8.23761 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 9.32155 5.19462 4.69849 7.23774 8.44903 6.66407 numMergedOcc 0
6 mol 60 unq 0 iso 0 dist 8.04921 8.93538 5.71764 14.6942 9.96399 12.8147 numMergedOcc 0
7 mol 60 unq 1 iso 0 dist 8.04921 8.93538 5.71764 8.71681 7.55695 8.4312 numMergedOcc 0
8 mol 60 unq 2 iso 0 dist 8.04921 8.93538 5.71764 6.05904 8.82176 7.48086 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 9.67948 9.74956 10.4065 11.4909 6.43433 16.0815 numMergedOcc 0
10 mol 112 unq 1 iso 0 dist 9.67948 9.74956 10.4065 13.1737 9.92283 19.115 numMergedOcc 0
11 mol 112 unq 2 iso 0 dist 6.55773 6.93938 10.4065 10.3209 6.43433 16.0815 numMergedOcc 0
12 mol 112 unq 3 iso 0 dist 6.55773 6.93938 10.4065 13.9635 9.92283 19.115 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 9.2746 7.79263 6.71103 6.63018 7.99857 11.2897 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 9.2746 7.79263 6.71103 9.23197 8.56342 12.31 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 7.83401 8.64976 6.41475 6.89903 8.56003 13.0577 numMergedOcc 0
16 mol 133 unq 1 iso 0 dist 7.83401 9.52159 8.77816 6.89903 8.56003 14.8099 numMergedOcc 0
17 mol 141 unq 0 iso 0 dist 6.78772 7.20083 12.7644 7.862 6.69515 13.1553 numMergedOcc 0
18 mol 141 unq 1 iso 0 dist 6.78772 7.20083 12.7644 5.64577 7.86572 12.176 numMergedOcc 0
19 mol 167 unq 0 iso 0 dist 8.28222 5.57495 8.12678 6.7811 9.94125 11.9239 numMergedOcc 0
20 mol 167 unq 1 iso 0 dist 8.28222 9.38297 14.8789 6.7811 9.94125 15.9727 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 8.45863 8.70011 11.6757 11.4345 7.05523 16.026 numMergedOcc 0
22 mol 214 unq 1 iso 0 dist 8.45863 8.70011 11.6757 7.3913 8.46327 13.9627 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 6.52129 9.97859 8.5378 5.65307 5.52379 8.63015 numMergedOcc 0
24 mol 248 unq 0 iso 0 dist 5.75155 8.50239 8.10311 6.63791 6.77954 10.9541 numMergedOcc 0
