0 mol 25 unq 0 iso 0 dist 8.41008 8.01293 6.80822 12.7595 6.39668 6.63839 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 8.40835 10.0341 8.82649 14.502 11.5334 6.84337 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 5.8166 11.8719 8.10708 15.046 9.98108 9.43355 numMergedOcc 0
3 mol 59 unq 1 iso 0 dist 5.8166 11.8719 8.10708 15.9596 12.8035 7.9327 numMergedOcc 0
4 mol 59 unq 2 iso 0 dist 6.47468 11.8719 9.20253 15.046 15.8562 9.43355 numMergedOcc 0
5 mol 59 unq 3 iso 0 dist 6.47468 11.8719 9.20253 15.9596 10.3701 7.9327 numMergedOcc 0
6 mol 61 unq 0 iso 0 dist 5.97418 6.35361 9.46217 5.39827 9.89377 7.46994 numMergedOcc 0
7 mol 64 unq 0 iso 0 dist 8.91298 6.32902 8.64746 12.6363 7.07433 9.32552 numMergedOcc 0
8 mol 87 unq 0 iso 0 dist 5.92576 7.55769 7.2668 10.4395 5.71028 9.28624 numMergedOcc 0
9 mol 87 unq 1 iso 0 dist 5.92576 7.55769 7.2668 7.14461 6.57984 8.31175 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 9.52282 10.6273 6.0026 14.2133 5.70312 6.0652 numMergedOcc 0
11 mol 130 unq 0 iso 0 dist 6.5114 6.47346 6.26422 10.2599 5.11595 9.62236 numMergedOcc 0
12 mol 130 unq 1 iso 0 dist 6.5114 6.47346 6.26422 12.5281 9.37324 6.90634 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 4.46578 6.27514 6.61636 11.8818 10.745 6.51868 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 4.46578 6.27514 6.61636 9.93823 11.3682 7.34698 numMergedOcc 0
15 mol 167 unq 0 iso 0 dist 6.6514 6.77802 9.72291 7.93807 7.33075 7.80054 numMergedOcc 0
16 mol 189 unq 0 iso 0 dist 8.81184 5.79318 7.65477 7.45329 6.41248 9.33695 numMergedOcc 0
17 mol 189 unq 1 iso 0 dist 8.81184 4.88868 8.2926 7.45329 6.41248 6.31466 numMergedOcc 0
18 mol 227 unq 0 iso 0 dist 9.09371 18.05 9.47836 18.2108 10.0092 9.52615 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 7.3389 6.63358 7.10557 5.94224 5.61995 6.8972 numMergedOcc 0
