0 mol 74 unq 0 iso 0 dist 9.23721 13.6619 7.94725 8.12821 8.42173 7.98596 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 6.19716 12.7355 9.86664 9.88601 6.97741 3.37578 numMergedOcc 0
2 mol 76 unq 1 iso 0 dist 8.1489 8.54904 9.86664 5.7965 6.97741 3.37578 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 9.65012 10.5635 8.04168 8.04056 8.51933 12.3073 numMergedOcc 0
4 mol 79 unq 1 iso 0 dist 9.65012 8.26855 5.70907 8.04056 8.51933 3.29053 numMergedOcc 0
5 mol 79 unq 2 iso 0 dist 7.10351 14.0819 8.04168 6.99991 8.51933 12.3073 numMergedOcc 0
6 mol 79 unq 3 iso 0 dist 7.10351 6.06978 5.70907 6.99991 8.51933 3.29053 numMergedOcc 0
7 mol 83 unq 0 iso 0 dist 9.79038 10.7221 7.26995 12.297 5.9281 3.65203 numMergedOcc 0
8 mol 83 unq 1 iso 0 dist 6.07392 6.36916 7.26995 5.2891 5.9281 3.65203 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 8.65878 13.6732 6.11331 13.3616 8.06621 11.6769 numMergedOcc 0
10 mol 170 unq 0 iso 0 dist 5.42919 5.03025 5.13268 3.64682 7.48765 4.57041 numMergedOcc 0
11 mol 173 unq 0 iso 0 dist 5.01585 7.29413 7.17037 7.24368 9.02222 11.5009 numMergedOcc 0
12 mol 213 unq 0 iso 0 dist 6.15846 6.86914 9.62911 3.57799 7.56327 8.61517 numMergedOcc 0
13 mol 230 unq 0 iso 0 dist 7.03084 3.86571 7.07833 6.74388 6.31092 5.53923 numMergedOcc 0
14 mol 250 unq 0 iso 0 dist 5.01762 9.20475 7.22664 10.8025 7.5999 3.18526 numMergedOcc 0
15 mol 250 unq 1 iso 0 dist 5.01762 9.20475 7.22664 9.58034 9.50976 4.97183 numMergedOcc 0
16 mol 250 unq 2 iso 0 dist 5.01762 4.62181 7.15762 10.8025 7.5999 9.28743 numMergedOcc 0
17 mol 250 unq 3 iso 0 dist 5.01762 4.62181 7.15762 9.58034 9.50976 6.00379 numMergedOcc 0
18 mol 250 unq 4 iso 0 dist 8.50588 9.20475 8.43577 10.8025 7.1454 3.18526 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 9.84667 10.0046 7.14086 7.2283 8.78525 10.1726 numMergedOcc 0
