0 mol 9 unq 0 iso 0 dist 9.8978 6.67398 9.57198 10.298 7.28672 8.04924 11.3797 9.62394 5.60154 9.78006 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 6.26276 9.03359 9.57198 9.93613 7.28672 8.04924 11.7623 9.62394 5.60154 9.78006 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.27369 10.1809 7.3022 6.73259 5.30297 7.61055 4.09495 10.177 9.87119 5.69955 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 9.27369 10.1809 7.3022 6.73259 5.30297 7.61055 8.18809 7.36856 4.74747 8.6385 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 8.96382 5.37126 8.809 12.4294 8.51024 8.06525 8.14567 6.84011 5.31367 6.34525 numMergedOcc 0
5 mol 115 unq 0 iso 0 dist 6.66022 5.46352 5.60389 11.2871 9.18958 9.9928 10.9437 12.13 11.7126 5.72642 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 8.4733 6.02826 7.26955 10.1992 11.7884 5.85818 10.8613 14.2293 7.36192 7.99857 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 8.4733 6.02826 7.26955 10.1992 11.7884 5.85818 13.6062 17.9198 10.6679 8.56342 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 9.80819 11.6995 9.73927 5.06687 7.89336 8.12589 5.59872 10.8708 12.144 9.02318 numMergedOcc 0
9 mol 148 unq 1 iso 0 dist 9.80819 11.6995 9.73927 5.06687 7.89336 8.12589 9.27313 6.22055 10.2478 9.74542 numMergedOcc 0
10 mol 148 unq 2 iso 0 dist 9.80819 11.6995 9.73927 5.06687 7.89336 8.12589 8.61198 11.2961 6.29254 7.97543 numMergedOcc 0
11 mol 150 unq 0 iso 0 dist 9.81665 11.8035 9.66129 5.09809 7.86976 8.11592 9.25213 6.14675 10.2318 9.6606 numMergedOcc 0
12 mol 150 unq 1 iso 0 dist 9.81665 11.8035 9.66129 5.09809 7.86976 8.11592 8.68422 11.2313 6.25747 7.85526 numMergedOcc 0
13 mol 150 unq 2 iso 0 dist 9.81665 11.8035 9.66129 5.09809 7.86976 8.11592 5.56996 10.9703 12.154 8.94552 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 6.95568 6.28043 6.32777 15.4119 11.1881 9.52987 15.0411 10.6908 10.0524 6.51749 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 6.95568 6.28043 6.32777 15.4119 11.1881 9.52987 11.8932 11.3325 5.95965 7.20392 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 9.37017 14.7966 9.33696 11.8182 5.87427 7.48284 4.04545 8.10214 12.0548 8.57261 numMergedOcc 0
17 mol 195 unq 0 iso 0 dist 8.13947 4.04021 9.82588 12.5586 11.4252 9.79691 17.3581 17.8873 13.6975 6.60567 numMergedOcc 0
18 mol 195 unq 1 iso 0 dist 8.13947 4.04021 9.82588 12.5586 11.4252 9.79691 8.95444 11.9628 6.08211 7.62942 numMergedOcc 0
