0 mol 26 unq 0 iso 0 dist 8.98417 10.7786 5.497 12.6093 9.11311 7.97596 13.3003 4.36675 6.15893 9.82851 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 5.60663 4.09894 8.58829 11.8742 8.56365 12.2529 16.1289 11.4396 17.448 5.82264 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 5.60663 4.09894 8.58829 5.44298 7.47783 5.98272 6.8073 9.17835 9.8428 7.32996 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 9.22889 6.26867 5.9249 4.08459 5.79139 4.39784 11.3356 8.10444 9.71811 7.63923 numMergedOcc 0
4 mol 79 unq 1 iso 0 dist 6.64915 5.79235 5.9249 8.65653 5.79139 4.39784 9.21479 8.10444 9.71811 7.63923 numMergedOcc 0
5 mol 134 unq 0 iso 0 dist 7.50264 5.43722 6.93279 11.8519 8.31198 8.4466 13.1655 6.26901 12.7491 9.81349 numMergedOcc 0
6 mol 146 unq 0 iso 0 dist 8.68292 7.14836 6.50043 5.97454 6.73137 6.19717 10.7403 5.54669 9.44952 5.95148 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 6.86997 6.43817 8.73468 7.34563 9.17462 10.8312 7.46919 4.32771 9.73927 5.75959 numMergedOcc 0
8 mol 148 unq 1 iso 0 dist 6.86997 6.43817 8.73468 7.34563 9.17462 10.8312 8.24581 5.84014 12.6536 6.6946 numMergedOcc 0
9 mol 148 unq 2 iso 0 dist 7.46919 6.43817 9.73927 7.34563 5.75959 10.8312 6.86997 4.32771 8.73468 9.17462 numMergedOcc 0
10 mol 148 unq 3 iso 0 dist 7.46919 6.43817 9.73927 7.34563 5.75959 10.8312 8.24581 4.26306 12.6536 6.6946 numMergedOcc 0
11 mol 150 unq 0 iso 0 dist 6.79381 6.48058 8.73558 7.33121 9.01668 10.8596 7.36989 4.39943 9.66129 5.4798 numMergedOcc 0
12 mol 150 unq 1 iso 0 dist 6.79381 6.48058 8.73558 7.33121 9.01668 10.8596 8.17805 5.93611 12.6576 6.32391 numMergedOcc 0
13 mol 150 unq 2 iso 0 dist 7.36989 6.48058 9.66129 7.33121 5.4798 10.8596 6.79381 4.39943 8.73558 9.01668 numMergedOcc 0
14 mol 150 unq 3 iso 0 dist 7.36989 6.48058 9.66129 7.33121 5.4798 10.8596 8.17805 4.30207 12.6576 6.32391 numMergedOcc 0
15 mol 158 unq 0 iso 0 dist 7.23059 10.405 9.6096 6.50596 4.6512 5.30823 13.0624 6.5476 12.3466 9.45696 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 6.20426 9.12244 9.33696 8.6599 8.4784 4.61059 13.2745 9.01338 11.4648 8.34477 numMergedOcc 0
17 mol 256 unq 0 iso 0 dist 9.65136 5.34142 7.48269 6.51471 4.36333 3.89364 9.47921 6.10011 6.71249 6.96483 numMergedOcc 0
18 mol 256 unq 1 iso 0 dist 7.54955 8.04009 7.48269 5.24147 4.36333 3.89364 11.9361 6.10011 6.71249 6.96483 numMergedOcc 0
