0 mol 17 unq 0 iso 0 dist 8.7483 5.84559 9.13617 4.12287 8.44037 6.64199 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 8.74311 5.66828 6.18197 4.50098 6.76158 5.42412 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 8.74311 5.66828 6.18197 8.14695 7.423 8.09862 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 8.74311 5.66828 6.18197 9.01546 5.89257 8.89114 numMergedOcc 0
4 mol 32 unq 0 iso 0 dist 7.41509 9.63542 5.64731 3.24351 7.52145 7.72377 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 5.41906 6.64844 4.50032 8.59614 7.12713 7.44805 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 6.61052 9.56769 7.40375 6.84869 4.74574 8.988 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 9.36203 4.93315 10.5572 4.85685 8.1717 8.96898 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 8.65864 5.05941 4.77004 14.3512 8.26805 9.50939 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 5.66981 6.35449 5.57673 4.62104 5.24882 6.38786 numMergedOcc 0
10 mol 211 unq 0 iso 0 dist 9.05403 8.96942 4.83833 12.8384 7.78316 7.4575 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 5.73488 8.621 5.97855 3.64687 6.15671 6.35772 numMergedOcc 0
