0 mol 12 unq 0 iso 0 dist 9.44587 7.00815 8.47217 11.7466 6.65972 6.96422 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.7004 6.81961 6.56527 10.6968 11.553 5.497 numMergedOcc 0
2 mol 32 unq 0 iso 0 dist 6.67704 5.31805 8.5315 6.76514 5.52033 4.62858 numMergedOcc 0
3 mol 32 unq 1 iso 0 dist 6.67079 9.70906 8.5315 9.86244 5.52033 4.62858 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 9.09041 10.427 8.87742 11.8362 11.51 9.63599 numMergedOcc 0
5 mol 79 unq 1 iso 0 dist 9.09041 10.427 8.87742 16.4089 11.4135 8.01743 numMergedOcc 0
6 mol 156 unq 0 iso 0 dist 8.32841 5.309 8.21184 10.4764 8.79853 7.30946 numMergedOcc 0
7 mol 156 unq 1 iso 0 dist 6.00295 5.309 5.41575 10.4764 5.69209 7.30946 numMergedOcc 0
8 mol 156 unq 2 iso 0 dist 6.56065 11.9245 8.21184 14.9176 8.79853 7.30946 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 8.50938 12.7855 7.32087 15.4846 10.6325 9.06217 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 8.50938 12.7855 7.32087 15.7863 8.45963 7.13252 numMergedOcc 0
11 mol 193 unq 0 iso 0 dist 6.28889 9.7127 9.40801 8.52642 4.17434 7.60625 numMergedOcc 0
12 mol 194 unq 0 iso 0 dist 9.819 14.3175 6.1886 21.5834 11.8663 8.52969 numMergedOcc 0
13 mol 232 unq 0 iso 0 dist 6.71099 7.46856 9.78181 6.37335 5.12599 7.17337 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 8.52162 6.32646 5.92374 7.90344 4.38002 6.62002 numMergedOcc 0
15 mol 238 unq 1 iso 0 dist 8.52162 6.32646 5.92374 11.8385 14.6816 9.69818 numMergedOcc 0
16 mol 238 unq 2 iso 0 dist 8.52162 6.32646 5.92374 11.5829 11.5793 6.73446 numMergedOcc 0
17 mol 250 unq 0 iso 0 dist 9.71793 11.464 9.70149 11.6461 6.40578 6.28538 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 8.16005 5.63899 7.16346 11.9076 13.9948 8.68913 numMergedOcc 0
19 mol 284 unq 0 iso 0 dist 5.24993 4.47263 7.34931 8.6173 6.76453 6.61376 numMergedOcc 0
