0 mol 7 unq 0 iso 0 dist 9.96415 14.6751 9.67164 12.0214 8.0744 5.72491 10.9229 5.5683 8.72114 10.1959 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.96415 7.15287 5.99459 12.0214 8.0744 7.88043 12.916 6.12483 5.99972 7.25346 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 9.96415 7.15287 5.99459 11.7931 11.7002 8.80762 12.916 6.12483 5.99972 10.0658 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 8.14598 9.20254 7.95042 4.61828 4.47891 6.60423 13.4332 10.0453 9.41441 11.9395 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 8.25594 15.6547 9.03564 17.7612 10.5332 6.77886 17.8435 9.76482 7.16773 8.25666 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 7.69222 6.97502 6.45841 9.94595 6.69436 5.16364 9.87816 6.26495 6.02816 9.03289 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 5.82056 6.97502 5.61588 9.94595 5.50891 5.16364 9.87816 8.26195 6.02816 9.03289 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 9.09115 6.97502 7.83244 9.94595 4.75954 5.16364 9.87816 12.382 6.02816 9.03289 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 9.71342 6.29782 5.58833 14.1322 7.06894 8.03372 15.1742 9.30433 9.36851 6.84211 numMergedOcc 0
9 mol 129 unq 1 iso 0 dist 9.71342 6.29782 5.58833 14.1322 7.06894 8.03372 10.9456 4.28744 4.97175 4.53459 numMergedOcc 0
10 mol 129 unq 2 iso 0 dist 8.57774 5.99695 5.58833 10.5849 7.06894 8.03372 7.32407 9.30433 9.36851 6.84211 numMergedOcc 0
11 mol 129 unq 3 iso 0 dist 8.57774 5.99695 5.58833 10.5849 7.06894 8.03372 6.48695 4.28744 4.97175 4.53459 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 9.70788 10.1013 7.36975 17.0851 9.05786 8.41611 9.98349 12.207 7.78652 15.0801 numMergedOcc 0
13 mol 143 unq 1 iso 0 dist 9.70788 10.1013 7.36975 17.0851 9.05786 8.41611 13.9605 14.7271 8.91301 15.0315 numMergedOcc 0
14 mol 143 unq 2 iso 0 dist 9.70788 10.1013 7.36975 11.9348 3.75378 7.63338 9.98349 12.207 7.78652 11.5146 numMergedOcc 0
15 mol 143 unq 3 iso 0 dist 9.70788 10.1013 7.36975 11.9348 3.75378 7.63338 13.9605 14.7271 8.91301 13.434 numMergedOcc 0
16 mol 143 unq 4 iso 0 dist 9.70788 10.1013 7.36975 17.2248 14.0356 9.03707 9.98349 12.207 7.78652 8.97873 numMergedOcc 0
17 mol 143 unq 5 iso 0 dist 9.70788 10.1013 7.36975 17.2248 14.0356 9.03707 13.9605 14.7271 8.91301 6.29542 numMergedOcc 0
18 mol 143 unq 6 iso 0 dist 9.70788 10.1013 7.36975 12.6044 9.30534 7.25673 9.98349 12.207 7.78652 6.60479 numMergedOcc 0
19 mol 143 unq 7 iso 0 dist 9.70788 10.1013 7.36975 12.6044 9.30534 7.25673 13.9605 14.7271 8.91301 7.54337 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 5.27578 9.09826 7.05695 12.7948 8.1007 6.72641 8.5303 3.78314 7.76163 6.71237 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 8.25953 6.51869 7.05695 12.4707 8.1007 6.72641 11.0449 3.78314 7.76163 6.71237 numMergedOcc 0
22 mol 223 unq 0 iso 0 dist 7.27963 10.6103 6.42257 10.2511 4.40141 6.13306 16.0359 10.5752 7.48463 6.80048 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 9.67281 11.2453 9.72188 13.1395 13.0611 7.32982 16.8938 17.1065 9.24557 4.77308 numMergedOcc 0
24 mol 259 unq 0 iso 0 dist 8.40328 6.18571 5.85442 14.0925 7.32929 8.55558 10.9688 4.47425 7.08526 6.31909 numMergedOcc 0
25 mol 259 unq 1 iso 0 dist 8.2518 6.18571 6.95511 14.0925 9.55426 8.55558 10.9688 4.10176 7.08526 6.31909 numMergedOcc 0
