0 mol 26 unq 0 iso 0 dist 8.98417 12.6093 9.11311 18.68 12.1978 8.36742 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 9.98746 5.05082 6.53981 11.8742 4.47203 7.47596 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 7.48563 7.22521 7.55367 10.848 10.5027 5.85622 numMergedOcc 0
3 mol 101 unq 0 iso 0 dist 7.73086 4.4529 9.44645 9.78643 9.70552 6.54699 numMergedOcc 0
4 mol 102 unq 0 iso 0 dist 9.2062 6.04036 6.07633 11.8703 9.38204 9.5434 numMergedOcc 0
5 mol 123 unq 0 iso 0 dist 9.52442 14.0666 7.30244 19.8968 11.011 8.0933 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 7.50264 11.8519 8.31198 19.6873 16.7805 9.3873 numMergedOcc 0
7 mol 134 unq 1 iso 0 dist 7.50264 11.8519 8.31198 16.3911 16.2362 9.66726 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 8.71007 5.93647 6.75593 10.1869 12.6641 7.74168 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 8.71007 8.51016 8.83562 10.1869 12.6641 8.16507 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 8.07946 5.34159 7.20362 8.36163 4.29509 4.68068 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 6.23057 13.1148 9.17562 16.1249 11.5821 8.27988 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 5.63477 3.50159 5.59832 11.6365 9.83112 8.27988 numMergedOcc 0
13 mol 232 unq 0 iso 0 dist 6.83927 6.92845 9.89191 10.0659 10.7624 4.76819 numMergedOcc 0
14 mol 241 unq 0 iso 0 dist 9.30143 5.1104 8.73192 11.8311 9.36013 9.87415 numMergedOcc 0
15 mol 253 unq 0 iso 0 dist 9.29788 12.9301 9.82605 11.1436 8.89634 8.24401 numMergedOcc 0
16 mol 253 unq 1 iso 0 dist 9.29788 8.8893 9.73723 11.1436 8.89634 8.44543 numMergedOcc 0
17 mol 253 unq 2 iso 0 dist 9.50983 16.4827 9.82605 14.5589 8.89634 8.24401 numMergedOcc 0
18 mol 253 unq 3 iso 0 dist 9.50983 13.3075 9.73723 14.5589 8.89634 8.44543 numMergedOcc 0
19 mol 256 unq 0 iso 0 dist 9.65136 6.51471 4.36333 9.75158 5.9669 8.3597 numMergedOcc 0
20 mol 256 unq 1 iso 0 dist 7.54955 5.24147 4.36333 12.1903 5.9669 8.3597 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 8.51736 6.4179 8.31526 12.0438 8.02986 6.92906 numMergedOcc 0
22 mol 258 unq 1 iso 0 dist 8.51736 11.4354 7.08328 12.0438 8.02986 5.57978 numMergedOcc 0
23 mol 278 unq 0 iso 0 dist 9.73172 14.4747 8.1769 15.5152 7.41736 5.35362 numMergedOcc 0
24 mol 278 unq 1 iso 0 dist 9.73172 10.0491 7.1656 15.5152 7.41736 8.22364 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 9.24164 13.3369 9.78784 14.0925 8.0692 5.76793 numMergedOcc 0
