0 mol 4 unq 0 iso 0 dist 8.15534 5.12159 6.12485 5.69329 7.88748 4.10578 7.58769 6.21697 6.86951 10.4152 numMergedOcc 0
1 mol 29 unq 0 iso 0 dist 9.27422 8.44709 7.50258 5.61941 6.04161 5.97852 12.6954 7.34641 5.36278 9.64034 numMergedOcc 0
2 mol 133 unq 0 iso 0 dist 7.47105 11.193 9.2759 6.43647 5.9959 4.85121 16.1349 12.1681 5.79195 9.97064 numMergedOcc 0
3 mol 133 unq 1 iso 0 dist 7.47105 11.193 9.2759 6.43647 5.9959 4.85121 12.4593 11.2107 8.76088 9.33041 numMergedOcc 0
4 mol 139 unq 0 iso 0 dist 7.83417 7.11333 8.78382 5.21231 7.20542 3.82037 10.7751 9.781 9.70154 6.79625 numMergedOcc 0
5 mol 182 unq 0 iso 0 dist 5.63632 6.04551 6.38335 4.13718 5.61979 5.2973 12.9886 11.427 8.27913 13.3411 numMergedOcc 0
6 mol 182 unq 1 iso 0 dist 5.63632 6.04551 6.38335 4.13718 5.61979 5.2973 8.21538 9.71185 8.85111 11.4615 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 6.58174 10.9794 6.20044 5.10199 5.81438 7.35194 15.0667 8.63339 6.62514 12.857 numMergedOcc 0
8 mol 204 unq 1 iso 0 dist 6.58174 10.9794 6.20044 5.10199 5.81438 7.35194 16.9923 11.09 9.41996 13.8492 numMergedOcc 0
9 mol 214 unq 0 iso 0 dist 7.24175 11.0439 5.86911 10.996 8.44407 4.54444 16.1156 8.94237 7.82201 12.0564 numMergedOcc 0
10 mol 214 unq 1 iso 0 dist 7.24175 11.0439 5.86911 5.055 6.0155 7.05353 16.1156 8.94237 7.82201 13.7263 numMergedOcc 0
11 mol 214 unq 2 iso 0 dist 7.24175 11.0439 5.86911 10.6488 8.89981 12.9344 16.1156 8.94237 7.82201 13.0479 numMergedOcc 0
12 mol 266 unq 0 iso 0 dist 7.72433 5.86368 6.57444 5.78744 8.95841 10.6488 13.8533 13.1611 9.39714 19.0368 numMergedOcc 0
13 mol 266 unq 1 iso 0 dist 7.72433 4.95934 7.9555 5.78744 8.95841 9.70494 9.46926 6.70676 8.8646 8.62843 numMergedOcc 0
14 mol 266 unq 2 iso 0 dist 9.46926 4.95934 8.8646 5.78744 8.62843 9.70494 7.72433 6.70676 7.9555 8.95841 numMergedOcc 0
15 mol 287 unq 0 iso 0 dist 4.98604 5.51191 6.45597 5.04841 6.06665 5.19406 10.1896 5.69849 9.18785 10.6454 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 4.98604 5.51191 6.45597 5.04841 6.06665 5.19406 10.1896 5.69849 9.18785 10.6454 numMergedOcc 0
17 mol 289 unq 0 iso 0 dist 4.98604 5.51191 6.45597 5.04841 6.06665 5.19406 10.1896 5.69849 9.18785 10.6454 numMergedOcc 0
