0 mol 21 unq 0 iso 0 dist 6.93185 4.20216 5.63735 9.35562 3.76294 7.05407 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 5.497 5.11733 6.7142 6.79475 5.39199 8.96682 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.90835 4.22398 6.88052 7.79336 7.68459 7.01952 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 8.90835 4.22398 6.88052 7.08559 5.70782 4.58552 numMergedOcc 0
4 mol 39 unq 0 iso 0 dist 6.24515 6.96883 6.13351 8.98219 3.91611 5.27182 numMergedOcc 0
5 mol 39 unq 1 iso 0 dist 6.47855 5.88718 6.13351 7.30265 3.91611 5.27182 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 7.03226 4.00608 7.46095 9.4866 10.1364 9.59729 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 9.63599 4.1859 9.77084 6.52939 9.51372 8.64934 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 9.63599 8.68431 6.5551 6.52939 9.51372 8.7515 numMergedOcc 0
9 mol 79 unq 2 iso 0 dist 8.01743 5.95598 9.77084 11.9367 9.51372 8.64934 numMergedOcc 0
10 mol 79 unq 3 iso 0 dist 8.01743 4.47084 6.5551 11.9367 9.51372 8.7515 numMergedOcc 0
11 mol 105 unq 0 iso 0 dist 5.03173 4.67929 7.77089 13.1083 13.4342 9.17843 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 8.55616 9.48887 9.0176 7.43401 6.93712 8.62504 numMergedOcc 0
13 mol 134 unq 1 iso 0 dist 8.73604 5.67107 9.0176 11.7151 6.93712 8.62504 numMergedOcc 0
14 mol 134 unq 2 iso 0 dist 6.93279 5.58312 7.83568 10.253 15.3699 8.14226 numMergedOcc 0
15 mol 141 unq 0 iso 0 dist 5.26989 4.22522 5.29898 12.0433 10.1551 7.92216 numMergedOcc 0
16 mol 143 unq 0 iso 0 dist 6.97487 5.43382 5.06564 14.6265 10.0079 9.29944 numMergedOcc 0
17 mol 143 unq 1 iso 0 dist 6.46089 4.38322 5.06564 10.55 10.0079 9.29944 numMergedOcc 0
18 mol 181 unq 0 iso 0 dist 7.05653 5.82984 8.06308 6.76746 11.9796 9.92831 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 9.84492 6.00734 9.99396 10.5584 4.03697 8.5672 numMergedOcc 0
20 mol 195 unq 0 iso 0 dist 9.82588 4.18074 9.24936 9.32333 5.66395 6.396 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 7.69296 6.2381 5.31416 10.1796 3.94038 8.25329 numMergedOcc 0
22 mol 214 unq 1 iso 0 dist 7.69296 9.8806 5.44533 10.1796 3.94038 4.85332 numMergedOcc 0
23 mol 225 unq 0 iso 0 dist 7.73748 6.24324 7.7086 11.7254 6.67492 9.3502 numMergedOcc 0
24 mol 227 unq 0 iso 0 dist 7.57454 4.09934 8.91971 12.0306 15.624 8.85955 numMergedOcc 0
25 mol 227 unq 1 iso 0 dist 7.57454 4.09934 8.91971 7.79951 12.8337 6.09335 numMergedOcc 0
26 mol 235 unq 0 iso 0 dist 7.31773 4.47008 8.97952 9.85304 10.6687 6.03081 numMergedOcc 0
27 mol 235 unq 1 iso 0 dist 7.31773 4.47008 8.97952 10.6744 10.6919 7.41433 numMergedOcc 0
28 mol 273 unq 0 iso 0 dist 8.85779 4.42663 5.61969 9.35749 10.5462 9.02537 numMergedOcc 0
29 mol 292 unq 0 iso 0 dist 5.7131 6.87619 8.6233 9.24197 6.89106 8.1635 numMergedOcc 0
30 mol 292 unq 1 iso 0 dist 5.7131 6.87619 8.6233 6.1905 3.92782 6.22943 numMergedOcc 0
31 mol 292 unq 2 iso 0 dist 5.7131 6.87619 8.6233 5.84792 5.93687 9.23612 numMergedOcc 0
