0 mol 0 unq 0 iso 0 dist 9.5614 5.25456 7.15528 10.0273 9.19662 6.26831 9.56842 11.2263 5.24778 6.64713 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 5.55156 7.1599 7.15528 12.1007 9.19662 6.26831 11.9994 11.2263 5.24778 6.64713 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 8.18518 6.57145 4.54938 8.63204 5.18512 6.92532 10.5195 6.41575 4.97119 6.39966 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 8.18518 6.01189 7.82074 8.63204 5.18512 6.36455 10.5195 6.41575 6.01808 6.39966 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 6.85331 9.20254 6.86014 4.61828 6.00575 6.60423 10.7574 7.33768 4.32034 9.69752 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 6.85331 9.20254 6.86014 4.61828 6.00575 6.60423 12.8157 7.29868 8.52463 9.36461 numMergedOcc 0
6 mol 60 unq 0 iso 0 dist 8.8058 5.09908 8.33063 8.4928 9.62257 9.96399 11.6385 11.816 11.2415 4.65127 numMergedOcc 0
7 mol 60 unq 1 iso 0 dist 8.8058 10.0675 8.7531 8.4928 9.62257 7.55695 11.6385 11.816 5.94827 4.65127 numMergedOcc 0
8 mol 100 unq 0 iso 0 dist 9.57498 6.89762 6.45675 6.14415 9.52882 7.12017 10.0156 15.8683 9.75737 9.5669 numMergedOcc 0
9 mol 114 unq 0 iso 0 dist 9.24515 5.24877 7.5732 7.73842 11.128 6.34525 14.9324 19.2926 12.7083 9.35942 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 6.86297 7.56632 9.09754 12.4751 9.97575 8.64409 15.9731 16.2017 11.6919 7.46987 numMergedOcc 0
11 mol 188 unq 0 iso 0 dist 7.63268 7.63236 9.96154 9.53031 4.46081 8.47347 10.4355 9.38004 6.43967 5.73306 numMergedOcc 0
12 mol 222 unq 0 iso 0 dist 7.27481 5.68063 6.00706 9.04499 6.42798 7.862 13.0565 9.07471 7.75466 9.08955 numMergedOcc 0
13 mol 222 unq 1 iso 0 dist 7.27481 5.68063 6.00706 9.04499 6.42798 7.862 15.9525 9.8062 12.1951 8.88664 numMergedOcc 0
14 mol 222 unq 2 iso 0 dist 7.27481 5.68063 6.00706 9.04499 6.42798 7.862 15.2255 10.6381 11.6161 7.16819 numMergedOcc 0
15 mol 272 unq 0 iso 0 dist 4.78812 5.27123 8.33638 7.11691 8.7909 8.46061 8.64133 13.0773 6.32008 9.18635 numMergedOcc 0
16 mol 272 unq 1 iso 0 dist 6.62923 11.9042 9.97651 7.11691 4.86504 9.64269 8.64133 12.0724 10.2227 9.18635 numMergedOcc 0
17 mol 272 unq 2 iso 0 dist 6.62923 5.27123 8.46116 7.11691 4.86504 8.46061 8.64133 12.0724 6.32008 9.18635 numMergedOcc 0
