0 mol 7 unq 0 iso 0 dist 6.66645 9.60361 8.0744 12.0608 8.15894 12.8006 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.22017 9.60361 11.7002 12.0608 8.45544 12.8006 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.32113 7.54282 9.45442 4.56199 7.90721 10.2011 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.32155 5.19462 4.69849 10.4149 7.15901 8.34145 numMergedOcc 0
4 mol 71 unq 0 iso 0 dist 8.87417 5.21993 11.5395 6.52737 9.16452 11.5039 numMergedOcc 0
5 mol 83 unq 0 iso 0 dist 6.69262 6.61587 8.10255 9.40112 7.26995 8.66111 numMergedOcc 0
6 mol 83 unq 1 iso 0 dist 6.69262 8.24464 12.3077 9.40112 7.26995 14.2815 numMergedOcc 0
7 mol 89 unq 0 iso 0 dist 6.17795 6.00509 4.01045 5.87704 6.65534 8.05579 numMergedOcc 0
8 mol 112 unq 0 iso 0 dist 9.67948 9.74956 10.4065 7.65123 9.97483 9.84243 numMergedOcc 0
9 mol 112 unq 1 iso 0 dist 9.67948 9.74956 10.4065 7.04523 5.43933 6.96745 numMergedOcc 0
10 mol 112 unq 2 iso 0 dist 9.67948 9.74956 10.4065 6.74766 4.99604 10.1168 numMergedOcc 0
11 mol 112 unq 3 iso 0 dist 9.67948 9.74956 10.4065 12.703 7.44041 16.2365 numMergedOcc 0
12 mol 112 unq 4 iso 0 dist 6.55773 6.93938 10.4065 6.00039 5.43933 6.96745 numMergedOcc 0
13 mol 112 unq 5 iso 0 dist 6.55773 6.93938 10.4065 10.0699 9.97483 9.84243 numMergedOcc 0
14 mol 112 unq 6 iso 0 dist 6.55773 6.93938 10.4065 3.50778 4.99604 10.1168 numMergedOcc 0
15 mol 112 unq 7 iso 0 dist 6.55773 6.93938 10.4065 12.7907 7.44041 16.2365 numMergedOcc 0
16 mol 133 unq 0 iso 0 dist 7.83401 8.64976 6.41475 9.97336 9.05336 12.971 numMergedOcc 0
17 mol 133 unq 1 iso 0 dist 7.83401 9.52159 8.77816 9.97336 9.05336 16.5057 numMergedOcc 0
18 mol 141 unq 0 iso 0 dist 6.78772 7.20083 12.7644 12.017 6.77921 17.2272 numMergedOcc 0
19 mol 213 unq 0 iso 0 dist 7.5552 7.31478 12.5919 4.44853 9.62911 7.90657 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 6.52129 9.97859 8.5378 6.10342 6.53286 4.66186 numMergedOcc 0
21 mol 270 unq 0 iso 0 dist 5.63728 9.99229 6.79831 4.5781 8.49032 11.0896 numMergedOcc 0
