0 mol 91 unq 0 iso 0 dist 8.79631 11.8012 5.11803 7.33106 7.37948 6.88024 numMergedOcc 0
1 mol 107 unq 0 iso 0 dist 6.54047 6.07557 8.83855 4.9878 7.02709 8.49615 numMergedOcc 0
2 mol 110 unq 0 iso 0 dist 8.47503 7.12329 4.78944 9.01215 6.60331 3.94206 numMergedOcc 0
3 mol 110 unq 1 iso 0 dist 8.47503 7.12329 4.78944 14.7021 9.22311 7.58348 numMergedOcc 0
4 mol 113 unq 0 iso 0 dist 6.75841 9.36148 9.43487 10.8457 5.82487 11.0812 numMergedOcc 0
5 mol 113 unq 1 iso 0 dist 6.75841 8.97401 9.97052 10.8457 5.82487 8.67499 numMergedOcc 0
6 mol 113 unq 2 iso 0 dist 6.75841 13.828 7.3324 10.8457 5.82487 5.19652 numMergedOcc 0
7 mol 125 unq 0 iso 0 dist 8.46765 9.62793 9.87276 11.2041 6.72613 5.51248 numMergedOcc 0
8 mol 125 unq 1 iso 0 dist 8.46765 15.9431 9.97204 11.2041 6.72613 7.48533 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 6.51716 7.59533 4.80778 12.4997 8.75049 13.46 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 6.51716 11.1028 6.58803 12.4997 8.75049 13.7612 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 6.51716 14.2535 9.96967 12.4997 8.75049 12.9605 numMergedOcc 0
12 mol 133 unq 3 iso 0 dist 6.51716 9.61802 6.31523 12.4997 8.75049 4.64588 numMergedOcc 0
13 mol 143 unq 0 iso 0 dist 8.03632 5.06968 9.32503 9.35855 9.3169 6.49108 numMergedOcc 0
14 mol 143 unq 1 iso 0 dist 8.03632 5.06968 9.32503 5.23542 5.5639 6.15159 numMergedOcc 0
15 mol 143 unq 2 iso 0 dist 8.03632 9.27464 8.58421 9.35855 9.3169 9.79072 numMergedOcc 0
16 mol 143 unq 3 iso 0 dist 8.03632 9.27464 8.58421 5.23542 5.5639 5.80488 numMergedOcc 0
17 mol 157 unq 0 iso 0 dist 9.44918 9.55356 6.09357 9.2854 7.52643 3.99423 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 5.41217 9.38036 8.71602 9.17649 9.16817 4.94882 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 8.39846 14.1885 6.96758 4.85878 8.76788 12.271 numMergedOcc 0
