0 mol 34 unq 0 iso 0 dist 7.79336 4.22398 7.01952 16.3505 9.41098 14.0196 numMergedOcc 0
1 mol 39 unq 0 iso 0 dist 7.30265 5.88718 5.27182 10.7428 9.17793 5.16873 numMergedOcc 0
2 mol 39 unq 1 iso 0 dist 7.30265 9.13695 9.75289 10.7428 9.17793 3.66393 numMergedOcc 0
3 mol 39 unq 2 iso 0 dist 7.30265 10.424 9.12545 10.7428 9.17793 3.08793 numMergedOcc 0
4 mol 53 unq 0 iso 0 dist 7.11695 4.06789 5.40489 9.15119 9.32314 9.49077 numMergedOcc 0
5 mol 53 unq 1 iso 0 dist 7.58093 6.57749 5.40489 14.2778 9.32314 9.49077 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 8.35444 8.12865 8.66724 3.75088 6.23509 7.21298 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 7.95451 5.6999 5.7369 8.98865 5.64092 3.74917 numMergedOcc 0
8 mol 68 unq 1 iso 0 dist 7.95451 5.6999 5.7369 6.85428 8.71074 10.1736 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 5.73203 4.44936 8.14226 5.45 6.76852 5.00648 numMergedOcc 0
10 mol 134 unq 1 iso 0 dist 6.57379 4.44936 5.78982 5.45 4.94473 5.00648 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 7.46803 9.4389 9.29944 4.19541 6.60366 10.4448 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 7.25339 4.4803 8.36129 6.54455 9.4366 10.872 numMergedOcc 0
13 mol 186 unq 1 iso 0 dist 7.25339 5.92278 5.86483 6.54455 9.4366 11.366 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 8.66162 9.11693 5.00369 3.99343 7.33774 5.80328 numMergedOcc 0
15 mol 204 unq 1 iso 0 dist 8.66162 9.11693 5.00369 11.4601 6.39122 3.68217 numMergedOcc 0
16 mol 204 unq 2 iso 0 dist 5.3819 8.39741 9.26214 6.68247 8.23717 9.94456 numMergedOcc 0
17 mol 204 unq 3 iso 0 dist 5.3819 8.39741 9.26214 7.51762 7.98864 8.03752 numMergedOcc 0
18 mol 204 unq 4 iso 0 dist 5.3819 4.08137 5.00369 6.68247 8.23717 4.7839 numMergedOcc 0
19 mol 204 unq 5 iso 0 dist 5.3819 4.08137 5.00369 7.51762 7.98864 4.05102 numMergedOcc 0
20 mol 214 unq 0 iso 0 dist 9.58372 7.451 4.85332 6.05252 7.70062 4.84709 numMergedOcc 0
21 mol 214 unq 1 iso 0 dist 9.58372 7.451 4.85332 4.00138 7.66702 4.16963 numMergedOcc 0
22 mol 217 unq 0 iso 0 dist 9.59084 5.88376 9.37602 8.12816 6.19602 10.2731 numMergedOcc 0
23 mol 217 unq 1 iso 0 dist 9.59084 4.22021 8.26522 8.12816 6.19602 4.56185 numMergedOcc 0
24 mol 237 unq 0 iso 0 dist 7.12731 6.17314 9.86835 4.43574 9.50001 4.75995 numMergedOcc 0
25 mol 272 unq 0 iso 0 dist 8.84523 5.46368 8.55539 9.97731 5.53492 6.35929 numMergedOcc 0
