0 mol 7 unq 0 iso 0 dist 5.99459 7.78327 7.00508 6.06176 8.81608 13.2302 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 7.26268 8.91596 6.37026 6.68431 8.74576 10.9253 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 5.38524 7.4785 5.77163 5.98837 7.03126 5.48837 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 5.38524 7.4785 5.77163 8.48255 9.68228 13.9198 numMergedOcc 0
4 mol 58 unq 2 iso 0 dist 8.69057 8.34191 11.7295 4.55117 7.03126 8.88313 numMergedOcc 0
5 mol 58 unq 3 iso 0 dist 8.69057 8.34191 11.7295 13.3401 9.68228 18.9418 numMergedOcc 0
6 mol 58 unq 4 iso 0 dist 8.69057 6.39747 5.77163 4.55117 7.03126 5.48837 numMergedOcc 0
7 mol 58 unq 5 iso 0 dist 8.69057 6.39747 5.77163 13.3401 9.68228 13.9198 numMergedOcc 0
8 mol 72 unq 0 iso 0 dist 9.74228 8.26541 4.38233 6.00418 9.14817 10.3769 numMergedOcc 0
9 mol 72 unq 1 iso 0 dist 7.12321 4.86198 4.38233 9.0131 9.14817 10.3769 numMergedOcc 0
10 mol 72 unq 2 iso 0 dist 6.21799 6.62699 4.38233 6.11922 9.14817 10.3769 numMergedOcc 0
11 mol 72 unq 3 iso 0 dist 5.03251 6.62699 5.62585 6.11922 9.76686 10.3769 numMergedOcc 0
12 mol 72 unq 4 iso 0 dist 9.56773 8.98867 5.62585 9.93049 9.76686 10.3769 numMergedOcc 0
13 mol 72 unq 5 iso 0 dist 7.66093 6.62699 9.84528 6.11922 9.437 10.3769 numMergedOcc 0
14 mol 78 unq 0 iso 0 dist 6.85523 7.91148 6.99884 4.92509 5.47706 7.03887 numMergedOcc 0
15 mol 78 unq 1 iso 0 dist 6.85523 6.59794 3.75261 4.92509 5.47706 5.36451 numMergedOcc 0
16 mol 78 unq 2 iso 0 dist 6.85523 8.34957 10.6388 4.92509 5.47706 9.28354 numMergedOcc 0
17 mol 78 unq 3 iso 0 dist 5.77326 7.91148 4.75637 4.92509 8.07568 7.03887 numMergedOcc 0
18 mol 78 unq 4 iso 0 dist 5.77326 6.59794 5.62063 4.92509 8.07568 5.36451 numMergedOcc 0
19 mol 78 unq 5 iso 0 dist 5.77326 8.34957 3.81575 4.92509 8.07568 9.28354 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 7.36975 8.99891 14.4074 6.01455 7.05845 14.9694 numMergedOcc 0
21 mol 143 unq 1 iso 0 dist 7.36975 8.99891 14.4074 5.44503 8.18023 8.08798 numMergedOcc 0
22 mol 143 unq 2 iso 0 dist 5.40637 8.99891 5.94217 5.44503 7.46803 8.08798 numMergedOcc 0
23 mol 168 unq 0 iso 0 dist 6.02086 8.92592 3.5168 8.67522 7.06851 10.0147 numMergedOcc 0
24 mol 168 unq 1 iso 0 dist 6.02086 9.57452 5.43054 8.67522 7.06851 11.9783 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 6.64173 8.29467 5.09584 6.7991 9.09234 6.91878 numMergedOcc 0
26 mol 181 unq 1 iso 0 dist 9.01624 8.29467 11.4645 6.7991 6.76746 6.91878 numMergedOcc 0
27 mol 181 unq 2 iso 0 dist 9.55105 8.29467 11.5807 6.7991 8.92098 6.91878 numMergedOcc 0
28 mol 197 unq 0 iso 0 dist 9.10817 9.23086 17.435 5.2908 9.27218 9.77656 numMergedOcc 0
29 mol 219 unq 0 iso 0 dist 4.33238 9.64116 8.59843 4.74167 7.30481 14.1371 numMergedOcc 0
30 mol 248 unq 0 iso 0 dist 9.05018 7.79063 9.81612 6.48757 5.0345 10.7209 numMergedOcc 0
31 mol 287 unq 0 iso 0 dist 7.45616 5.30118 3.66473 7.23534 8.59762 5.50067 numMergedOcc 0
32 mol 288 unq 0 iso 0 dist 7.45616 5.30118 3.66473 7.23534 8.59762 5.50067 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 7.45616 5.30118 3.66473 7.23534 8.59762 5.50067 numMergedOcc 0
34 mol 292 unq 0 iso 0 dist 9.46442 9.96374 3.08474 12.1551 5.84792 3.93401 numMergedOcc 0
35 mol 292 unq 1 iso 0 dist 9.46442 5.41432 7.07029 12.1551 5.84792 11.613 numMergedOcc 0
36 mol 292 unq 2 iso 0 dist 7.30758 9.96374 6.12546 5.07048 9.08193 12.0466 numMergedOcc 0
37 mol 292 unq 3 iso 0 dist 7.30758 9.96374 6.12546 12.1551 8.73515 3.93401 numMergedOcc 0
38 mol 292 unq 4 iso 0 dist 7.30758 5.41432 5.21887 5.07048 9.08193 9.74768 numMergedOcc 0
39 mol 292 unq 5 iso 0 dist 7.30758 5.41432 5.21887 12.1551 8.73515 11.613 numMergedOcc 0
