0 mol 44 unq 0 iso 0 dist 7.85573 9.4798 11.6488 7.37043 8.6578 9.17518 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 6.60294 8.36115 5.2986 5.81582 5.47405 8.94097 numMergedOcc 0
2 mol 61 unq 1 iso 0 dist 6.60294 8.36115 5.2986 4.83991 9.08027 9.66368 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 9.80207 9.53176 10.3464 5.62882 13.1389 8.2657 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.93688 7.57958 5.02124 7.38289 10.4726 9.28578 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 5.28955 9.47892 8.00732 9.21153 12.4307 9.05798 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 5.28955 9.47892 8.00732 13.8865 13.5289 5.85818 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 5.46716 9.9492 6.50232 14.2311 13.4123 8.1582 numMergedOcc 0
8 mol 143 unq 1 iso 0 dist 5.46716 9.9492 6.50232 9.32969 10.3832 7.88655 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 9.71223 9.08641 14.6658 7.41978 17.0107 9.59034 numMergedOcc 0
10 mol 197 unq 0 iso 0 dist 6.50727 8.32685 5.92782 6.35266 9.12641 9.71865 numMergedOcc 0
11 mol 197 unq 1 iso 0 dist 7.84826 6.74777 5.92782 10.3477 9.12641 9.71865 numMergedOcc 0
12 mol 197 unq 2 iso 0 dist 7.56537 9.62514 10.1284 13.7046 16.7208 9.71865 numMergedOcc 0
13 mol 197 unq 3 iso 0 dist 9.89975 9.62514 16.3081 13.7046 22.5841 9.71865 numMergedOcc 0
14 mol 218 unq 0 iso 0 dist 6.2441 8.27907 11.0649 5.77167 11.6289 6.86795 numMergedOcc 0
15 mol 218 unq 1 iso 0 dist 6.2441 8.27907 11.0649 7.54799 11.6935 6.23898 numMergedOcc 0
16 mol 238 unq 0 iso 0 dist 9.46728 9.46582 6.23871 12.2456 12.8147 7.61203 numMergedOcc 0
17 mol 238 unq 1 iso 0 dist 9.46728 9.77231 10.1372 12.2456 12.8147 9.47845 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 8.68803 5.66792 7.4709 4.52384 11.7243 5.45844 numMergedOcc 0
19 mol 273 unq 0 iso 0 dist 9.52454 9.79283 6.32601 5.62645 10.285 6.94131 numMergedOcc 0
20 mol 273 unq 1 iso 0 dist 9.52454 9.79283 6.32601 8.08262 12.5738 9.84628 numMergedOcc 0
