0 mol 28 unq 0 iso 0 dist 5.06086 5.98169 8.11586 13.5108 15.14 9.28621 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 5.06086 5.98169 8.11586 5.51879 7.13468 8.94643 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 5.06086 5.98169 8.11586 11.3454 9.50693 8.36195 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 4.73829 8.1717 8.03385 10.5572 12.5846 8.96898 numMergedOcc 0
4 mol 81 unq 0 iso 0 dist 9.78763 7.94697 4.52409 4.76773 9.03754 8.57764 numMergedOcc 0
5 mol 81 unq 1 iso 0 dist 9.61137 7.94697 5.89527 4.76773 10.0978 8.57764 numMergedOcc 0
6 mol 114 unq 0 iso 0 dist 5.29259 8.18193 9.61655 5.64342 9.68809 5.87382 numMergedOcc 0
7 mol 159 unq 0 iso 0 dist 7.85513 8.11352 4.31404 4.67118 7.67418 8.61788 numMergedOcc 0
8 mol 169 unq 0 iso 0 dist 6.47837 6.18165 6.05322 12.2667 9.25597 6.27378 numMergedOcc 0
9 mol 171 unq 0 iso 0 dist 6.07578 8.00826 8.3501 4.53761 8.9886 8.82481 numMergedOcc 0
10 mol 176 unq 0 iso 0 dist 9.99263 9.1617 14.6487 12.7186 20.5527 9.1728 numMergedOcc 0
11 mol 176 unq 1 iso 0 dist 8.27087 6.32254 5.64063 13.0176 11.9702 9.60931 numMergedOcc 0
12 mol 176 unq 2 iso 0 dist 7.71329 8.89556 5.64063 14.8578 11.9702 9.60931 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 8.65437 6.15671 9.66765 5.97855 13.8911 6.35772 numMergedOcc 0
14 mol 258 unq 0 iso 0 dist 6.26195 8.95095 4.05528 12.1402 10.2307 6.90511 numMergedOcc 0
