0 mol 4 unq 0 iso 0 dist 9.30799 9.82621 9.63758 11.314 5.39008 10.7798 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 8.39908 11.2594 8.68949 7.00256 7.74386 6.04779 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.16644 5.16039 9.2922 5.2387 7.88961 6.45611 numMergedOcc 0
3 mol 55 unq 0 iso 0 dist 7.15203 7.39736 9.24055 5.46652 9.34552 12.3514 numMergedOcc 0
4 mol 55 unq 1 iso 0 dist 7.15203 5.09072 9.66898 5.46652 9.34552 7.15478 numMergedOcc 0
5 mol 56 unq 0 iso 0 dist 8.78393 8.77769 7.43409 4.27997 8.0757 5.81148 numMergedOcc 0
6 mol 56 unq 1 iso 0 dist 8.78393 8.77769 7.43409 11.9782 9.8958 10.7288 numMergedOcc 0
7 mol 56 unq 2 iso 0 dist 8.99619 6.57493 7.43409 6.41952 8.0757 5.81148 numMergedOcc 0
8 mol 56 unq 3 iso 0 dist 8.99619 6.57493 7.43409 4.83605 9.8958 10.7288 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 9.49371 10.6821 5.73235 11.3498 9.26231 10.2556 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 9.49371 15.7787 7.48127 11.3498 9.26231 8.90561 numMergedOcc 0
11 mol 76 unq 2 iso 0 dist 5.05941 10.205 5.73235 8.10722 9.26231 10.2556 numMergedOcc 0
12 mol 76 unq 3 iso 0 dist 5.05941 7.90785 7.48127 8.10722 9.26231 8.90561 numMergedOcc 0
13 mol 76 unq 4 iso 0 dist 9.66942 13.076 5.73235 5.66928 9.26231 10.2556 numMergedOcc 0
14 mol 76 unq 5 iso 0 dist 9.66942 10.5881 7.48127 5.66928 9.26231 8.90561 numMergedOcc 0
15 mol 83 unq 0 iso 0 dist 9.55654 15.1565 7.2118 12.3414 7.9309 9.9201 numMergedOcc 0
16 mol 99 unq 0 iso 0 dist 7.55765 10.8479 8.68674 5.91888 4.82346 8.61334 numMergedOcc 0
17 mol 99 unq 1 iso 0 dist 7.55765 10.8479 8.68674 10.0064 8.07233 12.2155 numMergedOcc 0
18 mol 104 unq 0 iso 0 dist 5.74478 8.79593 5.71279 6.02556 7.32917 5.78815 numMergedOcc 0
19 mol 104 unq 1 iso 0 dist 5.74478 8.79593 5.71279 4.09273 8.84844 10.2942 numMergedOcc 0
20 mol 131 unq 0 iso 0 dist 8.32304 8.6975 6.08846 6.8279 6.45169 9.13134 numMergedOcc 0
21 mol 131 unq 1 iso 0 dist 8.32304 13.631 9.19171 6.8279 6.45169 9.57821 numMergedOcc 0
22 mol 170 unq 0 iso 0 dist 5.13315 6.63708 4.44987 5.2781 9.15159 11.8056 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 8.39237 14.8436 6.72718 15.2663 9.60838 11.315 numMergedOcc 0
24 mol 192 unq 0 iso 0 dist 5.91901 5.1382 6.2016 5.88368 5.83093 6.16078 numMergedOcc 0
25 mol 198 unq 0 iso 0 dist 5.42463 5.73389 9.64195 5.71019 7.89026 8.91219 numMergedOcc 0
26 mol 204 unq 0 iso 0 dist 5.8391 13.9511 9.52029 6.03168 9.23669 13.8486 numMergedOcc 0
27 mol 204 unq 1 iso 0 dist 9.92924 19.252 9.52029 12.4493 9.23669 13.8486 numMergedOcc 0
28 mol 212 unq 0 iso 0 dist 8.48834 6.03246 7.6819 7.16819 9.1732 6.95437 numMergedOcc 0
29 mol 212 unq 1 iso 0 dist 8.48834 10.3667 6.36102 7.16819 9.1732 9.01479 numMergedOcc 0
30 mol 239 unq 0 iso 0 dist 8.87704 11.2878 8.86185 4.828 7.80073 10.1043 numMergedOcc 0
31 mol 239 unq 1 iso 0 dist 7.90944 4.55101 8.26312 14.6255 7.10828 13.8702 numMergedOcc 0
32 mol 239 unq 2 iso 0 dist 7.90944 10.4589 7.58554 14.6255 7.10828 8.46058 numMergedOcc 0
33 mol 239 unq 3 iso 0 dist 9.11375 10.978 8.86185 16.0386 7.80073 10.1043 numMergedOcc 0
34 mol 243 unq 0 iso 0 dist 6.0854 6.55274 4.64178 5.52989 8.1195 7.70076 numMergedOcc 0
35 mol 243 unq 1 iso 0 dist 6.0854 15.0967 9.16988 5.52989 8.1195 16.6703 numMergedOcc 0
36 mol 249 unq 0 iso 0 dist 6.88579 5.7486 3.67935 6.08224 5.70674 6.13333 numMergedOcc 0
37 mol 258 unq 0 iso 0 dist 9.64956 9.45852 8.70193 11.4415 9.65711 7.88062 numMergedOcc 0
38 mol 258 unq 1 iso 0 dist 9.64956 5.99858 7.25618 11.4415 9.65711 5.79358 numMergedOcc 0
39 mol 272 unq 0 iso 0 dist 8.38819 12.7454 5.37747 8.75845 5.34803 6.62729 numMergedOcc 0
