0 mol 0 unq 0 iso 0 dist 8.34244 8.66548 8.73015 5.96303 10.8762 6.94943 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.15893 9.06516 5.29055 14.3325 11.5353 6.38243 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 5.497 9.06516 4.76998 14.3325 9.5053 6.38243 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 8.90835 7.08559 5.70782 16.1649 10.5969 9.58596 numMergedOcc 0
4 mol 45 unq 0 iso 0 dist 5.55096 5.81001 4.06745 4.52443 8.80014 7.72462 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 7.6481 8.13051 5.45005 5.36808 6.62229 6.87028 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 9.52272 8.35444 14.2005 7.70178 16.4621 7.17026 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 6.0129 4.44979 3.92737 5.92812 10.3996 6.83746 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 6.0129 4.44979 3.92737 6.34014 10.5879 9.14707 numMergedOcc 0
9 mol 98 unq 2 iso 0 dist 6.0129 6.61111 3.94967 13.6622 8.43352 8.75597 numMergedOcc 0
10 mol 98 unq 3 iso 0 dist 6.0129 6.61111 3.94967 6.34014 10.5879 9.18457 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 5.79343 5.51885 4.08391 4.69847 9.17466 7.59156 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 7.26955 6.55202 10.3622 8.96522 16.0882 9.6121 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 7.26955 9.08536 14.9264 8.96522 16.0882 9.57341 numMergedOcc 0
14 mol 126 unq 0 iso 0 dist 7.36017 9.93613 5.50104 5.83002 5.94233 8.66815 numMergedOcc 0
15 mol 126 unq 1 iso 0 dist 5.14819 9.93613 7.02562 5.83002 8.56219 8.66815 numMergedOcc 0
16 mol 126 unq 2 iso 0 dist 6.84245 9.93613 11.1195 5.83002 11.9246 8.66815 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 8.55616 6.44575 11.5269 8.05714 9.30061 6.99345 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 8.55616 7.43401 6.93712 8.05714 9.30061 5.11043 numMergedOcc 0
19 mol 134 unq 2 iso 0 dist 6.21403 6.57379 6.32315 13.6926 14.687 8.48313 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 9.30424 7.46803 4.06908 7.12863 6.95372 8.68663 numMergedOcc 0
21 mol 162 unq 0 iso 0 dist 8.30984 6.65272 3.91051 5.80919 11.9834 8.99227 numMergedOcc 0
22 mol 162 unq 1 iso 0 dist 8.30984 6.65272 3.91051 6.12036 11.1941 7.86766 numMergedOcc 0
23 mol 162 unq 2 iso 0 dist 8.30984 6.65272 3.91051 9.96936 12.5961 9.3867 numMergedOcc 0
24 mol 186 unq 0 iso 0 dist 8.97471 7.25339 3.87082 6.20673 7.02575 6.07389 numMergedOcc 0
25 mol 194 unq 0 iso 0 dist 8.52969 7.10155 7.41775 7.69247 5.68348 6.72182 numMergedOcc 0
26 mol 227 unq 0 iso 0 dist 7.57454 7.79951 12.8337 5.92529 12.135 5.28771 numMergedOcc 0
27 mol 234 unq 0 iso 0 dist 7.43663 6.96257 10.7351 9.66782 11.4382 8.52295 numMergedOcc 0
28 mol 234 unq 1 iso 0 dist 9.25517 6.86569 5.96499 6.56378 6.00582 8.52295 numMergedOcc 0
29 mol 267 unq 0 iso 0 dist 9.01354 5.08174 5.68457 9.7551 12.5839 7.60505 numMergedOcc 0
30 mol 279 unq 0 iso 0 dist 9.24367 6.0283 9.85432 4.66909 13.2249 5.81528 numMergedOcc 0
31 mol 292 unq 0 iso 0 dist 5.7131 5.84792 5.93687 6.67435 11.9814 9.2558 numMergedOcc 0
32 mol 292 unq 1 iso 0 dist 5.7131 8.73515 9.40023 6.67435 11.9814 9.84946 numMergedOcc 0
