0 mol 127 unq 0 iso 0 dist 8.56066 7.07353 9.38655 8.70711 4.54592 7.37502 numMergedOcc 0
1 mol 131 unq 0 iso 0 dist 5.81867 7.94102 11.9936 6.10988 10.5299 5.06665 numMergedOcc 0
2 mol 131 unq 1 iso 0 dist 5.81867 9.10391 10.298 6.10988 10.5299 6.04064 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 5.99206 6.51716 9.11662 9.34662 12.9623 5.21958 numMergedOcc 0
4 mol 133 unq 1 iso 0 dist 7.4615 6.51716 7.88506 9.34662 12.8098 5.21958 numMergedOcc 0
5 mol 135 unq 0 iso 0 dist 6.14743 8.54569 6.64633 8.85575 10.1093 10.3579 numMergedOcc 0
6 mol 135 unq 1 iso 0 dist 7.64736 8.54569 9.30976 8.85575 4.78381 10.3579 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 6.63801 9.79295 4.0375 7.99796 5.04815 5.75305 numMergedOcc 0
8 mol 157 unq 0 iso 0 dist 6.11979 7.16062 4.70922 9.58718 10.4695 6.20748 numMergedOcc 0
9 mol 157 unq 1 iso 0 dist 6.11979 9.44918 8.78326 9.58718 10.4695 8.07977 numMergedOcc 0
10 mol 176 unq 0 iso 0 dist 6.01289 7.34613 12.1591 7.96385 6.49767 13.3098 numMergedOcc 0
11 mol 189 unq 0 iso 0 dist 7.36778 6.5048 7.92935 6.04271 6.24645 5.06462 numMergedOcc 0
12 mol 240 unq 0 iso 0 dist 8.04656 6.08469 6.72289 9.17002 5.03157 5.72529 numMergedOcc 0
13 mol 240 unq 1 iso 0 dist 8.04656 6.08469 6.72289 8.88893 12.8983 6.98179 numMergedOcc 0
14 mol 256 unq 0 iso 0 dist 6.6746 7.73757 9.63496 8.96004 8.66329 15.3507 numMergedOcc 0
15 mol 266 unq 0 iso 0 dist 9.52092 8.44218 8.5577 7.94609 12.7824 10.3103 numMergedOcc 0
16 mol 266 unq 1 iso 0 dist 6.79741 8.44218 3.56173 7.94609 9.94585 10.3103 numMergedOcc 0
17 mol 268 unq 0 iso 0 dist 9.36602 7.53404 10.1157 7.36234 6.95055 3.64231 numMergedOcc 0
18 mol 268 unq 1 iso 0 dist 9.36602 6.89651 12.8947 7.36234 6.95055 8.99096 numMergedOcc 0
19 mol 282 unq 0 iso 0 dist 8.363 7.71181 6.24352 8.35986 10.0321 7.68629 numMergedOcc 0
20 mol 282 unq 1 iso 0 dist 8.363 6.15611 9.05636 8.35986 10.0321 6.46939 numMergedOcc 0
