0 mol 67 unq 0 iso 0 dist 8.34804 7.29309 8.17929 6.23298 10.2575 9.30836 numMergedOcc 0
1 mol 67 unq 1 iso 0 dist 8.34804 4.31746 5.63802 6.23298 10.2575 6.58279 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.09675 7.25285 8.13535 6.70925 7.78899 5.30477 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.02753 5.90782 8.13535 8.95756 7.78899 5.30477 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 5.53726 11.0631 7.31426 9.88184 7.30364 7.2131 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 7.40577 3.88006 4.86767 10.7569 3.97585 7.78223 numMergedOcc 0
6 mol 147 unq 0 iso 0 dist 9.21476 7.38323 9.77522 6.00651 4.93993 5.08863 numMergedOcc 0
7 mol 162 unq 0 iso 0 dist 8.37231 7.15755 9.0087 9.51731 3.96207 8.62413 numMergedOcc 0
8 mol 185 unq 0 iso 0 dist 7.64068 6.26644 6.68054 5.40655 4.81985 8.56136 numMergedOcc 0
9 mol 185 unq 1 iso 0 dist 9.83898 5.9439 6.68054 13.4891 4.81985 8.56136 numMergedOcc 0
10 mol 217 unq 0 iso 0 dist 8.80103 10.7793 7.63191 5.89788 5.21449 6.14304 numMergedOcc 0
11 mol 217 unq 1 iso 0 dist 8.80103 10.7793 7.63191 13.1333 6.36283 9.95995 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 8.20598 4.73615 9.83883 11.8093 8.37757 9.82733 numMergedOcc 0
13 mol 279 unq 0 iso 0 dist 8.299 6.68035 5.94449 7.87072 9.69939 6.12347 numMergedOcc 0
14 mol 279 unq 1 iso 0 dist 8.299 4.47851 8.61452 7.87072 9.69939 8.79637 numMergedOcc 0
15 mol 279 unq 2 iso 0 dist 8.299 4.47851 8.61452 11.8078 12.0301 8.88458 numMergedOcc 0
16 mol 279 unq 3 iso 0 dist 8.299 13.5015 7.66302 16.9496 8.76427 8.16582 numMergedOcc 0
17 mol 294 unq 0 iso 0 dist 8.55037 7.33654 7.14502 16.1826 12.6882 9.7659 numMergedOcc 0
18 mol 294 unq 1 iso 0 dist 8.55037 7.33654 7.14502 5.27236 9.06411 6.1268 numMergedOcc 0
