0 mol 5 unq 0 iso 0 dist 9.13355 11.5915 7.50453 11.6542 3.33561 5.69239 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 8.09253 11.5593 6.77807 16.5042 8.56896 8.7908 numMergedOcc 0
2 mol 20 unq 0 iso 0 dist 9.22796 10.4896 7.99756 11.7008 4.7579 7.47395 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 6.03151 8.28528 5.4713 10.7521 6.08836 3.77542 numMergedOcc 0
4 mol 46 unq 1 iso 0 dist 6.03151 8.28528 5.4713 17.9678 14.1986 9.97314 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.78762 7.24635 5.45099 12.7979 3.35924 7.66068 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 9.78762 8.05782 8.44765 12.7979 3.35924 9.5043 numMergedOcc 0
7 mol 76 unq 2 iso 0 dist 9.78762 12.4827 9.06643 12.7979 3.35924 8.34132 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 6.90069 5.80317 9.38837 9.64265 4.83106 9.07629 numMergedOcc 0
9 mol 78 unq 1 iso 0 dist 6.90069 5.80317 9.38837 4.45433 4.315 8.61143 numMergedOcc 0
10 mol 116 unq 0 iso 0 dist 9.17843 4.13866 7.54274 7.70636 3.43966 6.55227 numMergedOcc 0
11 mol 116 unq 1 iso 0 dist 7.31364 10.1108 7.54274 6.82267 3.43966 6.55227 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 9.78215 5.51628 8.49847 11.7885 6.95147 7.53342 numMergedOcc 0
13 mol 168 unq 0 iso 0 dist 5.21801 10.3305 8.21227 13.0272 9.99868 5.86767 numMergedOcc 0
14 mol 168 unq 1 iso 0 dist 5.21801 10.3305 8.21227 11.3231 6.91388 5.28353 numMergedOcc 0
15 mol 194 unq 0 iso 0 dist 9.26885 5.30387 6.68939 9.66898 5.43825 9.55626 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 9.99496 6.16076 6.31365 10.1464 3.52598 7.83056 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 8.29663 8.05498 7.49606 12.295 7.35802 8.62655 numMergedOcc 0
18 mol 260 unq 1 iso 0 dist 8.01717 13.2373 9.73217 20.6039 15.6308 8.62655 numMergedOcc 0
19 mol 285 unq 0 iso 0 dist 9.26793 12.0007 4.27826 8.38399 3.14843 5.88958 numMergedOcc 0
20 mol 285 unq 1 iso 0 dist 9.26793 15.0759 5.82074 8.38399 3.14843 7.78121 numMergedOcc 0
