0 mol 43 unq 0 iso 0 dist 8.99509 8.47617 5.06502 4.97991 8.92291 6.79185 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 8.99509 5.73331 5.89973 4.97991 8.92291 8.37962 numMergedOcc 0
2 mol 43 unq 2 iso 0 dist 8.99509 8.48694 11.1644 4.97991 8.92291 12.0106 numMergedOcc 0
3 mol 43 unq 3 iso 0 dist 8.47617 8.99509 5.06502 4.97991 6.79185 8.92291 numMergedOcc 0
4 mol 43 unq 4 iso 0 dist 8.47617 5.73331 6.45462 4.97991 6.79185 8.37962 numMergedOcc 0
5 mol 43 unq 5 iso 0 dist 8.47617 8.48694 10.5986 4.97991 6.79185 12.0106 numMergedOcc 0
6 mol 43 unq 6 iso 0 dist 5.73331 8.99509 5.89973 4.97991 8.37962 8.92291 numMergedOcc 0
7 mol 43 unq 7 iso 0 dist 5.73331 8.47617 6.45462 4.97991 8.37962 6.79185 numMergedOcc 0
8 mol 43 unq 8 iso 0 dist 5.73331 8.48694 5.46146 4.97991 8.37962 12.0106 numMergedOcc 0
9 mol 62 unq 0 iso 0 dist 6.56664 9.58156 8.62608 4.11778 7.13406 13.0088 numMergedOcc 0
10 mol 62 unq 1 iso 0 dist 7.99003 9.52036 5.80772 7.3643 7.13406 10.9941 numMergedOcc 0
11 mol 62 unq 2 iso 0 dist 9.96382 7.59416 8.62608 9.77774 7.13406 13.0088 numMergedOcc 0
12 mol 75 unq 0 iso 0 dist 8.64872 8.96262 9.02771 4.28491 7.16975 10.7441 numMergedOcc 0
13 mol 110 unq 0 iso 0 dist 8.93253 8.1306 4.56913 6.03696 6.78225 6.2967 numMergedOcc 0
14 mol 110 unq 1 iso 0 dist 8.1306 8.93253 4.56913 6.03696 6.2967 6.78225 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 8.75736 6.32178 7.93571 5.1707 8.65986 10.5289 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 6.76166 7.2977 7.93571 6.2148 8.65986 10.5289 numMergedOcc 0
17 mol 206 unq 0 iso 0 dist 7.94694 7.51923 5.63422 11.3482 5.52084 11.0438 numMergedOcc 0
18 mol 213 unq 0 iso 0 dist 7.22234 8.48081 5.45334 14.5443 8.29133 8.96646 numMergedOcc 0
19 mol 213 unq 1 iso 0 dist 8.48081 7.22234 5.45334 14.5443 8.96646 8.29133 numMergedOcc 0
20 mol 213 unq 2 iso 0 dist 8.48081 7.22234 5.45334 15.4318 7.2016 11.529 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 6.15754 8.9413 5.88703 10.5297 7.72403 6.35438 numMergedOcc 0
22 mol 234 unq 1 iso 0 dist 8.9413 6.15754 5.88703 10.5297 6.35438 7.72403 numMergedOcc 0
23 mol 234 unq 2 iso 0 dist 4.91961 7.14333 10.2693 6.66957 6.35438 9.57132 numMergedOcc 0
24 mol 234 unq 3 iso 0 dist 7.14333 4.91961 10.2693 10.1896 9.07916 12.2772 numMergedOcc 0
25 mol 234 unq 4 iso 0 dist 7.14333 4.91961 10.2693 6.66957 9.57132 6.35438 numMergedOcc 0
26 mol 240 unq 0 iso 0 dist 7.0935 7.12912 4.28414 4.43802 7.55134 9.76302 numMergedOcc 0
27 mol 259 unq 0 iso 0 dist 6.20344 5.29682 4.69778 11.7777 7.64122 11.9769 numMergedOcc 0
