0 mol 2 unq 0 iso 0 dist 7.26738 9.3761 7.21955 6.38677 11.3896 9.39313 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.34858 9.72346 6.1032 12.1846 13.3446 8.93792 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 9.69923 4.9983 9.70187 6.38389 14.1293 4.90093 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 5.74157 5.98764 6.29235 10.5257 12.9853 6.8173 numMergedOcc 0
4 mol 102 unq 0 iso 0 dist 9.2958 9.00369 11.0733 13.457 16.6838 9.49592 numMergedOcc 0
5 mol 102 unq 1 iso 0 dist 9.2958 9.00369 11.0733 10.8385 13.1894 5.88034 numMergedOcc 0
6 mol 120 unq 0 iso 0 dist 6.74094 4.7751 4.36262 7.45509 11.6333 7.78914 numMergedOcc 0
7 mol 120 unq 1 iso 0 dist 6.74094 4.7751 4.36262 6.78986 8.86071 9.35938 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 7.19168 9.22913 10.4641 11.948 13.0621 5.18805 numMergedOcc 0
9 mol 142 unq 0 iso 0 dist 4.56239 6.4119 6.61855 5.20379 5.1557 5.79144 numMergedOcc 0
10 mol 142 unq 1 iso 0 dist 5.49328 8.40522 5.19808 11.3375 9.5355 5.79144 numMergedOcc 0
11 mol 156 unq 0 iso 0 dist 5.56994 8.08259 7.92829 6.02972 8.34508 9.15935 numMergedOcc 0
12 mol 156 unq 1 iso 0 dist 5.56994 8.08259 7.92829 9.81901 11.7694 8.24388 numMergedOcc 0
13 mol 156 unq 2 iso 0 dist 8.99176 8.08259 3.37658 6.02972 10.4665 9.15935 numMergedOcc 0
14 mol 156 unq 3 iso 0 dist 8.99176 8.08259 3.37658 9.81901 10.5248 8.24388 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 9.77482 9.2814 3.49733 12.0387 9.53304 6.11886 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 9.20248 9.0495 9.04752 10.1773 14.7598 6.8123 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 8.69185 4.54064 5.76999 4.96171 13.4278 8.43724 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 9.20713 8.95073 3.46565 11.3632 8.78148 8.26827 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 9.20713 8.95073 3.46565 5.56783 8.33415 7.9002 numMergedOcc 0
