0 mol 13 unq 0 iso 0 dist 5.4424 4.14738 8.05984 4.43066 3.53348 7.98465 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 9.03144 10.361 8.34024 15.4109 9.05087 7.11053 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.18109 4.78969 8.82122 9.90204 13.8687 5.91068 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 8.69443 4.07863 5.45575 11.2945 11.6399 8.67634 numMergedOcc 0
4 mol 112 unq 0 iso 0 dist 6.30128 6.40435 7.12413 9.80187 9.71348 8.91262 numMergedOcc 0
5 mol 112 unq 1 iso 0 dist 6.30128 6.40435 7.12413 4.77996 5.96497 6.12922 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 5.68599 6.11049 8.49888 9.76097 6.95933 8.50705 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 9.49104 5.90631 8.33489 9.13697 4.56331 5.52149 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 9.53814 6.56193 9.66935 13.8649 12.4577 8.42899 numMergedOcc 0
9 mol 173 unq 0 iso 0 dist 7.93816 7.23914 9.25763 10.3954 10.1842 8.62366 numMergedOcc 0
10 mol 173 unq 1 iso 0 dist 7.93816 7.23914 9.25763 14.3737 12.4786 9.44973 numMergedOcc 0
11 mol 173 unq 2 iso 0 dist 7.93816 7.23914 9.25763 12.0211 13.8624 6.52508 numMergedOcc 0
12 mol 195 unq 0 iso 0 dist 9.89207 5.6158 8.55725 11.9603 4.65091 9.32333 numMergedOcc 0
13 mol 195 unq 1 iso 0 dist 9.0153 4.04021 8.55725 9.48766 4.65091 9.32333 numMergedOcc 0
14 mol 235 unq 0 iso 0 dist 6.44932 4.28284 8.60471 11.0152 13.3458 7.02029 numMergedOcc 0
15 mol 273 unq 0 iso 0 dist 8.78928 13.7838 6.06557 11.7289 5.35498 9.35749 numMergedOcc 0
16 mol 274 unq 0 iso 0 dist 8.26851 5.95459 5.42845 4.97796 5.9397 6.66172 numMergedOcc 0
17 mol 274 unq 1 iso 0 dist 8.14634 5.95459 5.62484 4.97796 4.89003 6.66172 numMergedOcc 0
