0 mol 21 unq 0 iso 0 dist 9.35562 8.63857 15.9052 4.20216 7.05407 12.7465 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 6.79475 9.06516 9.56136 5.11733 8.96682 10.2011 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 7.79336 8.38156 13.1232 4.22398 7.01952 10.8709 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 7.79336 7.08559 3.39994 4.22398 7.01952 4.58552 numMergedOcc 0
4 mol 34 unq 2 iso 0 dist 7.08559 8.38156 12.7516 4.22398 4.58552 10.8709 numMergedOcc 0
5 mol 34 unq 3 iso 0 dist 7.08559 7.79336 3.39994 4.22398 4.58552 7.01952 numMergedOcc 0
6 mol 39 unq 0 iso 0 dist 7.30265 8.94353 9.75478 5.88718 5.27182 12.4536 numMergedOcc 0
7 mol 39 unq 1 iso 0 dist 7.30265 8.94353 9.75478 9.13695 9.75289 15.5754 numMergedOcc 0
8 mol 39 unq 2 iso 0 dist 7.30265 8.94353 9.75478 10.424 9.12545 17.5045 numMergedOcc 0
9 mol 59 unq 0 iso 0 dist 8.35444 6.52887 13.6068 8.12865 8.66724 12.8488 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 6.12922 8.91262 5.11 4.22481 7.31064 11.6819 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 7.43401 6.44575 5.83782 9.48887 8.62504 11.2397 numMergedOcc 0
12 mol 134 unq 1 iso 0 dist 5.73203 6.57379 4.87973 4.44936 8.14226 5.78982 numMergedOcc 0
13 mol 134 unq 2 iso 0 dist 6.57379 5.73203 4.87973 4.44936 5.78982 8.14226 numMergedOcc 0
14 mol 135 unq 0 iso 0 dist 9.09753 7.6337 3.61409 10.093 9.79585 11.8882 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 7.46803 8.18023 10.1474 9.4389 9.29944 9.94557 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 6.76746 9.09234 11.196 5.82984 9.92831 11.0482 numMergedOcc 0
17 mol 181 unq 1 iso 0 dist 6.76746 8.92098 3.55187 5.82984 9.92831 12.1187 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 8.24424 7.0942 3.55463 6.80416 9.01338 10.4838 numMergedOcc 0
19 mol 233 unq 1 iso 0 dist 8.24424 6.01775 8.23358 6.80416 9.01338 10.3829 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 7.24334 5.43613 11.1752 6.12722 4.66186 9.51483 numMergedOcc 0
21 mol 272 unq 0 iso 0 dist 8.84523 6.95241 9.5745 5.46368 8.55539 11.7203 numMergedOcc 0
22 mol 292 unq 0 iso 0 dist 6.1905 5.84792 4.99426 6.87619 6.22943 9.23612 numMergedOcc 0
23 mol 292 unq 1 iso 0 dist 6.1905 5.84792 4.99426 11.493 9.31056 13.842 numMergedOcc 0
24 mol 292 unq 2 iso 0 dist 6.1905 8.73515 8.21724 6.87619 6.22943 11.928 numMergedOcc 0
25 mol 292 unq 3 iso 0 dist 6.1905 8.73515 8.21724 11.493 9.31056 16.9048 numMergedOcc 0
26 mol 292 unq 4 iso 0 dist 5.84792 6.1905 4.99426 6.87619 9.23612 6.22943 numMergedOcc 0
27 mol 292 unq 5 iso 0 dist 5.84792 8.73515 3.57128 6.87619 9.23612 11.928 numMergedOcc 0
