0 mol 10 unq 0 iso 0 dist 8.50323 9.20508 9.43805 6.97549 9.76751 5.59978 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 8.50323 9.20508 9.43805 6.47424 5.66127 11.3122 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 8.50323 9.93682 5.98205 6.97549 9.76751 6.57715 numMergedOcc 0
3 mol 10 unq 3 iso 0 dist 8.50323 9.93682 5.98205 6.47424 5.66127 8.28568 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 9.04898 9.67696 11.2113 9.74777 8.31805 7.02381 numMergedOcc 0
5 mol 30 unq 0 iso 0 dist 7.54056 7.85546 8.6157 9.39194 7.63516 6.38009 numMergedOcc 0
6 mol 30 unq 1 iso 0 dist 7.54056 7.85546 8.6157 7.30322 3.68767 11.1138 numMergedOcc 0
7 mol 81 unq 0 iso 0 dist 5.62329 7.27852 9.83691 4.95504 7.01382 6.27606 numMergedOcc 0
8 mol 109 unq 0 iso 0 dist 9.67848 6.45174 11.2032 5.81859 12.5868 9.63255 numMergedOcc 0
9 mol 109 unq 1 iso 0 dist 9.67848 8.46446 16.2359 5.81859 12.5868 4.0719 numMergedOcc 0
10 mol 123 unq 0 iso 0 dist 6.49558 7.36361 5.25923 8.09682 8.56894 7.88813 numMergedOcc 0
11 mol 123 unq 1 iso 0 dist 6.49558 7.36361 5.25923 8.35926 3.21474 4.10526 numMergedOcc 0
12 mol 123 unq 2 iso 0 dist 6.49558 7.36361 5.25923 7.41568 9.94939 12.6384 numMergedOcc 0
13 mol 130 unq 0 iso 0 dist 5.53721 5.65876 3.76328 7.50304 5.11518 3.90693 numMergedOcc 0
14 mol 130 unq 1 iso 0 dist 5.53721 9.13825 4.33496 7.50304 5.11518 4.86681 numMergedOcc 0
15 mol 173 unq 0 iso 0 dist 5.89342 6.07708 7.55884 9.31914 8.35404 8.66075 numMergedOcc 0
16 mol 182 unq 0 iso 0 dist 6.17569 9.38111 3.6277 8.54982 5.23001 7.30933 numMergedOcc 0
17 mol 184 unq 0 iso 0 dist 6.4064 9.13228 9.96392 7.42696 3.07409 12.8344 numMergedOcc 0
18 mol 184 unq 1 iso 0 dist 6.4064 9.13228 9.96392 5.86468 9.86813 6.04545 numMergedOcc 0
19 mol 184 unq 2 iso 0 dist 6.4064 9.13228 9.96392 8.73302 6.87402 4.12242 numMergedOcc 0
20 mol 184 unq 3 iso 0 dist 7.17252 9.13228 5.65874 7.42696 8.40636 12.8344 numMergedOcc 0
21 mol 184 unq 4 iso 0 dist 7.17252 9.13228 5.65874 5.86468 6.13585 6.04545 numMergedOcc 0
22 mol 184 unq 5 iso 0 dist 7.17252 9.13228 5.65874 8.73302 4.1284 4.12242 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 6.59468 8.88206 6.53702 9.08818 3.33782 5.34495 numMergedOcc 0
24 mol 218 unq 1 iso 0 dist 6.59468 8.88206 6.53702 8.5163 5.81454 8.27161 numMergedOcc 0
25 mol 230 unq 0 iso 0 dist 7.02381 9.3968 9.11193 9.64987 9.09582 6.21317 numMergedOcc 0
26 mol 230 unq 1 iso 0 dist 7.02381 9.3968 9.11193 7.12149 3.83847 11.6032 numMergedOcc 0
27 mol 278 unq 0 iso 0 dist 9.00962 7.29686 7.34781 7.73107 3.39646 4.02342 numMergedOcc 0
28 mol 278 unq 1 iso 0 dist 9.00962 9.62872 8.25822 7.73107 3.39646 8.79088 numMergedOcc 0
