0 mol 34 unq 0 iso 0 dist 9.12062 4.97286 5.70643 7.66913 10.8394 7.072 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 7.73902 9.03899 4.0144 9.91882 6.29545 10.2782 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 6.46901 9.37127 4.5746 6.9762 7.74382 11.7919 numMergedOcc 0
3 mol 46 unq 1 iso 0 dist 9.30547 9.37127 8.38581 6.9762 12.8186 11.7919 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 9.00111 8.17621 3.87295 8.51206 9.80356 6.12935 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 6.26722 8.58727 14.3686 9.29665 5.21047 17.809 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 6.26722 8.61597 6.37933 9.29665 5.21047 8.87738 numMergedOcc 0
7 mol 156 unq 0 iso 0 dist 6.72426 8.95171 4.20708 6.01599 4.33572 7.27063 numMergedOcc 0
8 mol 156 unq 1 iso 0 dist 6.72426 8.95171 4.20708 5.42285 6.11369 5.6621 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 6.76781 8.40335 4.43567 5.31279 4.11297 4.12555 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 6.22466 5.82681 7.99002 8.34668 5.18732 10.1169 numMergedOcc 0
11 mol 186 unq 2 iso 0 dist 6.22466 5.82681 7.99002 8.76308 12.1022 4.93748 numMergedOcc 0
12 mol 209 unq 0 iso 0 dist 6.3344 8.9906 9.9501 9.17634 7.34675 16.0742 numMergedOcc 0
13 mol 226 unq 0 iso 0 dist 9.31677 9.45587 4.31761 9.84017 13.393 13.003 numMergedOcc 0
14 mol 234 unq 0 iso 0 dist 5.65943 6.99317 4.99837 5.74541 6.06471 4.4231 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 6.58667 4.66834 4.80425 7.64361 13.7282 11.8 numMergedOcc 0
16 mol 277 unq 1 iso 0 dist 6.58667 8.90911 10.0416 7.64361 13.7282 10.7039 numMergedOcc 0
17 mol 277 unq 2 iso 0 dist 6.01542 4.66834 9.70521 7.64361 4.60075 11.8 numMergedOcc 0
18 mol 277 unq 3 iso 0 dist 6.01542 8.90911 8.11496 7.64361 4.60075 10.7039 numMergedOcc 0
19 mol 278 unq 0 iso 0 dist 8.79625 9.23937 7.97433 6.9592 4.74121 5.29258 numMergedOcc 0
20 mol 278 unq 1 iso 0 dist 9.9609 9.23937 13.6514 6.9592 14.9084 5.29258 numMergedOcc 0
