0 mol 13 unq 0 iso 0 dist 8.37063 5.04036 6.00386 6.39939 5.99004 7.98679 numMergedOcc 0
1 mol 13 unq 1 iso 0 dist 6.80844 5.04036 9.78622 6.39939 9.65051 7.98679 numMergedOcc 0
2 mol 44 unq 0 iso 0 dist 7.41011 7.03812 5.75226 10.0797 5.81645 7.03307 numMergedOcc 0
3 mol 44 unq 1 iso 0 dist 7.41011 7.03812 5.75226 6.29545 6.75026 7.25707 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 6.40355 9.28282 8.88275 5.53482 4.73362 10.489 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 6.40355 9.28282 8.88275 5.26304 9.61367 6.66954 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 4.98783 8.95651 12.5077 4.1125 6.48163 9.05259 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 9.28645 7.98999 12.9813 6.62328 7.03339 13.4033 numMergedOcc 0
8 mol 130 unq 0 iso 0 dist 4.69926 7.62584 7.14836 6.84415 6.87196 11.624 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 7.46875 7.27702 6.3223 4.34786 5.43662 6.48674 numMergedOcc 0
10 mol 162 unq 0 iso 0 dist 9.32658 8.9822 10.3457 4.7671 7.64707 11.9834 numMergedOcc 0
11 mol 162 unq 1 iso 0 dist 9.32658 8.32464 14.1212 4.7671 7.64707 12.5961 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 6.64341 8.78765 5.99781 4.37504 8.06003 11.895 numMergedOcc 0
13 mol 280 unq 0 iso 0 dist 4.26671 7.10354 6.70274 8.48093 9.55885 12.7351 numMergedOcc 0
