0 mol 7 unq 0 iso 0 dist 7.43675 7.12005 5.03532 3.87123 8.85869 9.02286 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.7135 7.12005 4.45508 3.87123 7.5298 9.02286 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.7135 7.12005 4.45508 15.7094 8.94874 12.71 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.72464 7.12005 5.41499 3.87123 7.87568 9.02286 numMergedOcc 0
4 mol 31 unq 0 iso 0 dist 9.47885 8.54682 4.89256 11.9537 7.22476 11.1984 numMergedOcc 0
5 mol 31 unq 1 iso 0 dist 9.47885 7.95952 8.58645 11.9537 7.22476 14.3492 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 7.42848 9.93082 15.5074 10.6473 6.10175 15.3763 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 9.97867 7.64322 6.99666 4.5316 8.06263 8.87151 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.54374 9.60441 16.7417 9.06972 6.95094 12.998 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 9.24258 6.27279 4.17212 6.99583 5.50364 5.43662 numMergedOcc 0
10 mol 131 unq 1 iso 0 dist 9.55246 6.27279 9.64263 6.99583 8.7301 5.43662 numMergedOcc 0
11 mol 147 unq 0 iso 0 dist 8.64606 8.71163 13.5514 7.83675 4.95086 14.8668 numMergedOcc 0
12 mol 147 unq 1 iso 0 dist 8.64606 8.71163 13.5514 14.9083 8.39524 21.2894 numMergedOcc 0
13 mol 176 unq 0 iso 0 dist 8.36552 7.96385 15.7327 10.3157 7.02608 16.169 numMergedOcc 0
14 mol 194 unq 0 iso 0 dist 8.78345 6.45779 13.9769 8.18585 5.69866 14.2824 numMergedOcc 0
15 mol 211 unq 0 iso 0 dist 7.79873 9.69937 13.9486 5.6174 7.15386 13.823 numMergedOcc 0
16 mol 211 unq 1 iso 0 dist 7.79873 9.69937 13.9486 4.00712 7.73993 8.76958 numMergedOcc 0
17 mol 211 unq 2 iso 0 dist 7.79873 9.69937 13.9486 10.088 9.45365 16.5783 numMergedOcc 0
18 mol 226 unq 0 iso 0 dist 7.28604 5.54783 4.87605 9.41453 9.05082 6.95495 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 7.96566 9.07337 11.6565 4.91015 7.98871 13.2544 numMergedOcc 0
