0 mol 26 unq 0 iso 0 dist 8.62527 6.67455 5.02457 8.99751 10.4631 5.60332 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.62527 6.67455 5.02457 9.44507 12.1978 7.30207 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 7.45133 9.84967 12.0187 8.51496 4.96793 10.8606 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 8.86877 9.04514 9.87339 9.42728 7.21306 6.54946 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 8.86877 9.04514 9.87339 7.93341 4.88983 10.2729 numMergedOcc 0
5 mol 63 unq 0 iso 0 dist 9.99115 7.09184 5.31186 8.51942 6.10379 7.85496 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 7.49861 9.82294 11.7446 6.23138 6.11938 8.95689 numMergedOcc 0
7 mol 64 unq 1 iso 0 dist 6.2165 9.82294 12.8925 6.23138 4.43442 8.95689 numMergedOcc 0
8 mol 163 unq 0 iso 0 dist 6.96837 9.24754 8.71765 9.62943 8.83719 3.7064 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 9.51041 8.57666 15.9087 7.42278 7.35345 10.4516 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 9.99964 8.90161 4.12983 5.97968 7.23046 5.51195 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 6.93144 7.11262 4.12983 8.50382 7.23046 5.51195 numMergedOcc 0
12 mol 181 unq 2 iso 0 dist 7.04782 6.60648 4.12983 9.07527 14.9846 12.2278 numMergedOcc 0
13 mol 195 unq 0 iso 0 dist 9.39697 9.35664 5.87625 8.13947 6.45756 7.07871 numMergedOcc 0
14 mol 195 unq 1 iso 0 dist 4.86882 9.35664 8.32665 8.13947 5.65165 7.07871 numMergedOcc 0
15 mol 244 unq 0 iso 0 dist 8.19381 9.06357 13.4361 5.79898 11.4169 14.3408 numMergedOcc 0
16 mol 244 unq 1 iso 0 dist 8.93421 9.06357 5.39827 5.79898 12.7764 14.3408 numMergedOcc 0
17 mol 244 unq 2 iso 0 dist 7.35657 9.06357 5.10436 5.79898 12.7037 14.3408 numMergedOcc 0
18 mol 244 unq 3 iso 0 dist 6.19605 9.06357 7.77495 5.79898 8.63792 14.3408 numMergedOcc 0
