0 mol 8 unq 0 iso 0 dist 8.80278 8.37509 4.43686 7.70793 15.2304 14.4767 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 8.73998 8.37509 15.5539 7.70793 7.20987 14.4767 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 8.17979 5.94326 8.05216 5.94965 5.26654 5.47388 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 6.57749 4.52009 7.28199 9.05554 4.8818 10.3886 numMergedOcc 0
4 mol 130 unq 0 iso 0 dist 6.5114 7.04929 7.55204 9.24876 9.9146 9.10579 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 4.46578 6.90904 6.63023 7.83401 5.94764 5.45144 numMergedOcc 0
6 mol 143 unq 0 iso 0 dist 9.76501 8.20024 4.25746 7.52352 12.0243 12.5159 numMergedOcc 0
7 mol 143 unq 1 iso 0 dist 9.76501 7.19059 8.05158 7.52352 12.0243 6.07527 numMergedOcc 0
8 mol 148 unq 0 iso 0 dist 8.80448 7.76167 8.44462 9.14135 12.1075 6.41267 numMergedOcc 0
9 mol 148 unq 1 iso 0 dist 8.80448 8.63766 7.06829 9.14135 12.1075 6.8578 numMergedOcc 0
10 mol 148 unq 2 iso 0 dist 8.80448 8.42082 13.2635 9.14135 12.1075 8.58803 numMergedOcc 0
11 mol 150 unq 0 iso 0 dist 8.78855 7.83202 8.51103 9.12067 12.1551 6.48054 numMergedOcc 0
12 mol 150 unq 1 iso 0 dist 8.78855 8.7107 7.13108 9.12067 12.1551 6.83178 numMergedOcc 0
13 mol 150 unq 2 iso 0 dist 8.78855 8.47493 13.2655 9.12067 12.1551 8.52718 numMergedOcc 0
14 mol 178 unq 0 iso 0 dist 7.33326 8.65373 10.3834 7.25142 6.30779 6.90563 numMergedOcc 0
15 mol 178 unq 1 iso 0 dist 7.33326 8.6561 6.29739 7.25142 6.30779 4.39197 numMergedOcc 0
16 mol 178 unq 2 iso 0 dist 7.33326 9.1197 4.95286 7.25142 6.30779 10.0301 numMergedOcc 0
17 mol 189 unq 0 iso 0 dist 8.81184 9.22035 6.53924 5.15305 8.0379 6.45649 numMergedOcc 0
18 mol 189 unq 1 iso 0 dist 9.71306 9.22035 17.3417 5.15305 11.0529 6.45649 numMergedOcc 0
19 mol 189 unq 2 iso 0 dist 9.20296 9.22035 14.0791 5.15305 8.53414 6.45649 numMergedOcc 0
20 mol 272 unq 0 iso 0 dist 9.10712 7.37973 14.5292 7.36125 14.227 8.09107 numMergedOcc 0
21 mol 272 unq 1 iso 0 dist 9.10712 7.37973 14.5292 7.47128 11.2381 6.04884 numMergedOcc 0
