0 mol 1 unq 0 iso 0 dist 6.06669 9.25624 7.64327 5.1888 5.74199 4.34307 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 6.06669 5.84895 8.28595 5.1888 5.74199 5.03955 numMergedOcc 0
2 mol 1 unq 2 iso 0 dist 6.06669 3.79575 9.31967 5.1888 5.74199 7.31135 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 8.40835 3.71371 7.86029 13.4556 9.25986 12.3846 numMergedOcc 0
4 mol 69 unq 0 iso 0 dist 7.33546 5.14497 8.72237 7.83359 9.22636 8.99035 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 8.70106 14.2575 8.10965 11.4822 7.81042 4.76694 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 7.76707 4.6327 7.99359 8.37794 9.86842 11.3887 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 7.63425 6.12041 7.99359 12.9585 9.86842 11.3887 numMergedOcc 0
8 mol 132 unq 0 iso 0 dist 7.14447 4.73274 5.52837 12.8539 8.15549 9.98904 numMergedOcc 0
9 mol 165 unq 0 iso 0 dist 3.87901 6.29065 8.19939 9.24409 8.2197 13.729 numMergedOcc 0
10 mol 165 unq 1 iso 0 dist 5.04534 7.20557 8.19939 6.58447 8.2197 13.729 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 6.6514 6.25478 7.04009 10.8805 9.82329 6.20034 numMergedOcc 0
12 mol 184 unq 0 iso 0 dist 9.0757 10.3615 8.11014 16.3549 9.45847 13.0222 numMergedOcc 0
13 mol 184 unq 1 iso 0 dist 9.0757 10.3615 8.11014 6.55123 7.895 10.629 numMergedOcc 0
14 mol 184 unq 2 iso 0 dist 9.39563 11.4233 8.11014 3.95306 9.45847 13.0222 numMergedOcc 0
15 mol 184 unq 3 iso 0 dist 9.39563 11.4233 8.11014 17.0877 7.895 10.629 numMergedOcc 0
16 mol 184 unq 4 iso 0 dist 7.51045 4.96558 8.11014 9.14602 9.45847 13.0222 numMergedOcc 0
17 mol 184 unq 5 iso 0 dist 7.51045 4.96558 8.11014 13.1965 7.895 10.629 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 8.98221 5.29106 8.72113 13.6469 9.08767 13.0532 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 7.19924 9.3643 6.17408 15.6809 9.09835 12.3365 numMergedOcc 0
20 mol 239 unq 1 iso 0 dist 7.19924 9.3643 6.17408 12.3037 7.21466 9.92669 numMergedOcc 0
21 mol 239 unq 2 iso 0 dist 7.19924 9.47569 6.17602 15.6809 9.09835 13.2575 numMergedOcc 0
22 mol 239 unq 3 iso 0 dist 7.19924 9.47569 6.17602 12.3037 7.21466 12.0265 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 4.09984 8.15057 7.85044 9.64395 8.70702 5.71221 numMergedOcc 0
24 mol 285 unq 1 iso 0 dist 4.09984 8.15057 7.85044 10.5268 9.43706 9.42148 numMergedOcc 0
25 mol 285 unq 2 iso 0 dist 4.09984 8.15057 7.85044 6.59466 9.3482 14.2125 numMergedOcc 0
