0 mol 38 unq 0 iso 0 dist 7.96306 11.1811 8.86547 11.9552 5.09927 6.87122 numMergedOcc 0
1 mol 132 unq 0 iso 0 dist 9.00166 4.90475 6.2403 9.44592 7.87387 5.77186 numMergedOcc 0
2 mol 132 unq 1 iso 0 dist 7.16287 4.90475 6.495 9.44592 6.53135 5.77186 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 5.01269 6.49846 5.97805 10.4344 6.09234 9.72387 numMergedOcc 0
4 mol 163 unq 0 iso 0 dist 6.89529 4.12904 6.56115 11.9872 6.99664 9.90947 numMergedOcc 0
5 mol 163 unq 1 iso 0 dist 6.89529 4.12904 6.56115 9.37245 4.09125 8.16252 numMergedOcc 0
6 mol 167 unq 0 iso 0 dist 9.65404 6.32863 7.83781 8.95296 8.2701 5.36671 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 4.45738 4.30341 6.27396 9.68316 7.73767 7.16758 numMergedOcc 0
8 mol 210 unq 0 iso 0 dist 5.33103 3.84723 6.53736 9.25184 10.061 6.85824 numMergedOcc 0
9 mol 210 unq 1 iso 0 dist 9.01301 3.84723 8.18851 9.25184 5.11839 6.85824 numMergedOcc 0
10 mol 219 unq 0 iso 0 dist 8.55971 5.0241 9.68515 12.8918 9.54571 9.64116 numMergedOcc 0
11 mol 219 unq 1 iso 0 dist 7.26376 5.0241 8.09769 12.8918 12.3063 9.64116 numMergedOcc 0
12 mol 258 unq 0 iso 0 dist 9.17911 9.07364 9.67877 6.61322 13.3447 8.03012 numMergedOcc 0
13 mol 258 unq 1 iso 0 dist 9.52903 14.2753 9.67877 20.9486 13.3447 8.03012 numMergedOcc 0
14 mol 277 unq 0 iso 0 dist 6.70414 14.2115 9.84188 5.11998 5.11865 9.54359 numMergedOcc 0
15 mol 277 unq 1 iso 0 dist 6.70414 10.8075 8.35794 5.11998 5.11865 5.69112 numMergedOcc 0
16 mol 277 unq 2 iso 0 dist 6.70414 10.8075 8.35794 5.79925 8.46455 7.2091 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 6.90956 5.25853 7.30618 9.1471 6.33641 9.18744 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 6.90956 5.25853 7.30618 9.1471 6.33641 9.18744 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 6.90956 5.25853 7.30618 9.1471 6.33641 9.18744 numMergedOcc 0
20 mol 294 unq 0 iso 0 dist 5.71656 5.57606 8.52208 7.48987 5.13965 7.56669 numMergedOcc 0
