0 mol 1 unq 0 iso 0 dist 8.47429 9.40282 6.25854 4.61559 7.21349 6.4181 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.42607 6.49709 5.8961 7.4835 10.8687 5.95165 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 6.20956 6.49709 4.73237 7.4835 9.76946 5.95165 numMergedOcc 0
3 mol 14 unq 0 iso 0 dist 8.31896 9.28341 4.05028 4.97366 8.25832 6.87018 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.32868 9.96446 9.29076 5.27016 9.61119 8.4545 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 7.32868 6.70686 4.39652 5.27016 9.61119 7.01176 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 9.35364 8.49531 3.96825 4.84407 8.36326 8.69069 numMergedOcc 0
7 mol 122 unq 0 iso 0 dist 8.3907 8.47907 4.42285 5.08302 11.3932 9.40018 numMergedOcc 0
8 mol 122 unq 1 iso 0 dist 8.3907 8.47907 4.42285 11.2519 10.8894 6.78949 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 6.26722 8.66715 12.7925 13.3005 18.09 9.50322 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 6.26722 9.00172 12.7637 13.3005 18.09 5.82404 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 5.63173 8.95433 5.36939 15.4773 14.4181 9.50322 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 9.71025 6.44195 5.88662 5.32921 10.6788 9.93555 numMergedOcc 0
13 mol 154 unq 1 iso 0 dist 9.71025 7.34207 12.461 9.95968 17.924 6.23399 numMergedOcc 0
14 mol 163 unq 0 iso 0 dist 9.04436 7.75045 4.12904 4.49316 9.04757 9.63873 numMergedOcc 0
15 mol 167 unq 0 iso 0 dist 9.08229 6.53913 5.48405 4.88159 9.763 5.59806 numMergedOcc 0
16 mol 167 unq 1 iso 0 dist 7.99057 6.53913 10.8859 4.88159 12.538 5.59806 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 6.22466 9.52413 11.7795 16.5529 16.6123 8.03995 numMergedOcc 0
18 mol 195 unq 0 iso 0 dist 5.7709 4.78641 5.90604 8.94388 12.6983 7.63036 numMergedOcc 0
19 mol 196 unq 0 iso 0 dist 6.28071 9.36732 9.8977 5.01554 10.208 8.79558 numMergedOcc 0
20 mol 196 unq 1 iso 0 dist 6.28071 9.79271 4.59462 9.31621 7.556 9.99314 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 8.22331 6.18446 7.56497 10.0696 14.7463 8.3337 numMergedOcc 0
22 mol 235 unq 0 iso 0 dist 6.91126 6.45574 6.84447 9.7911 8.92054 8.48065 numMergedOcc 0
23 mol 235 unq 1 iso 0 dist 9.48967 6.45574 7.38431 9.7911 12.1257 8.48065 numMergedOcc 0
24 mol 235 unq 2 iso 0 dist 6.43002 8.14407 7.38431 10.656 12.1257 8.48065 numMergedOcc 0
25 mol 236 unq 0 iso 0 dist 6.79115 5.77925 4.38595 8.55909 11.1162 8.90987 numMergedOcc 0
26 mol 237 unq 0 iso 0 dist 5.73318 9.59483 4.51174 13.1097 10.4324 8.56463 numMergedOcc 0
27 mol 237 unq 1 iso 0 dist 5.73318 9.59483 4.51174 18.3553 13.0128 9.42743 numMergedOcc 0
28 mol 241 unq 0 iso 0 dist 5.66945 6.90245 6.72492 3.92006 9.40808 9.10633 numMergedOcc 0
