0 mol 26 unq 0 iso 0 dist 9.00844 9.80897 5.71065 4.28862 6.70325 7.98005 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 5.52908 9.79966 8.90634 11.1555 5.98867 11.4857 numMergedOcc 0
2 mol 33 unq 1 iso 0 dist 5.52908 5.52992 7.71372 11.1555 5.98867 11.6293 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 8.62137 5.40582 8.95809 8.51287 5.68794 11.3069 numMergedOcc 0
4 mol 64 unq 0 iso 0 dist 7.32896 9.15386 12.2159 12.9694 8.6701 19.8062 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 8.90763 7.25721 7.0643 14.0822 9.87102 16.3466 numMergedOcc 0
6 mol 210 unq 0 iso 0 dist 7.93965 6.13878 9.53948 5.81094 6.58557 11.1783 numMergedOcc 0
7 mol 226 unq 0 iso 0 dist 8.01046 5.90092 6.84726 13.2432 9.01607 14.2289 numMergedOcc 0
8 mol 233 unq 0 iso 0 dist 9.40942 7.41931 11.2631 12.8413 8.70416 16.85 numMergedOcc 0
9 mol 233 unq 1 iso 0 dist 9.40942 7.41931 11.2631 9.26192 8.18379 14.7568 numMergedOcc 0
10 mol 261 unq 0 iso 0 dist 8.50063 7.00833 4.25662 4.80385 7.14871 8.24356 numMergedOcc 0
11 mol 276 unq 0 iso 0 dist 8.12227 7.85804 7.18694 7.57747 8.50998 10.8848 numMergedOcc 0
12 mol 282 unq 0 iso 0 dist 8.99154 9.4493 9.07097 5.07365 7.21879 12.0535 numMergedOcc 0
