0 mol 9 unq 0 iso 0 dist 7.70405 9.5692 5.85081 14.3347 11.8626 6.11048 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 7.70405 9.5692 5.85081 12.1556 13.1565 8.14998 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 6.30598 13.7485 9.43839 19.4824 14.4751 7.69926 numMergedOcc 0
3 mol 95 unq 0 iso 0 dist 5.84349 6.56529 9.02905 7.90775 4.33346 7.51733 numMergedOcc 0
4 mol 95 unq 1 iso 0 dist 5.84349 6.56529 9.02905 9.96562 7.47119 9.01607 numMergedOcc 0
5 mol 122 unq 0 iso 0 dist 6.44313 7.85654 4.821 10.5967 6.28781 4.42563 numMergedOcc 0
6 mol 124 unq 0 iso 0 dist 8.55572 6.9986 8.50362 13.928 10.3233 8.57739 numMergedOcc 0
7 mol 126 unq 0 iso 0 dist 9.40595 11.433 5.78493 13.6842 4.57807 8.2777 numMergedOcc 0
8 mol 157 unq 0 iso 0 dist 6.53933 5.56117 7.75542 13.1435 11.5877 8.10592 numMergedOcc 0
9 mol 214 unq 0 iso 0 dist 7.24175 7.25055 9.46274 9.0058 14.5108 9.06459 numMergedOcc 0
10 mol 252 unq 0 iso 0 dist 9.4344 4.20436 9.09279 10.9853 5.96471 8.55044 numMergedOcc 0
11 mol 252 unq 1 iso 0 dist 5.41885 5.45887 9.09279 7.91348 5.96471 8.55044 numMergedOcc 0
12 mol 266 unq 0 iso 0 dist 6.20998 4.5731 4.95415 6.95233 5.98169 9.29666 numMergedOcc 0
13 mol 266 unq 1 iso 0 dist 8.78219 4.5731 6.38519 6.95233 13.8919 9.29666 numMergedOcc 0
14 mol 285 unq 0 iso 0 dist 8.17214 7.76515 6.07843 8.33653 5.93692 6.71946 numMergedOcc 0
15 mol 285 unq 1 iso 0 dist 8.17214 7.52611 9.66678 8.33653 5.93692 5.03601 numMergedOcc 0
16 mol 285 unq 2 iso 0 dist 4.49395 5.32175 7.08681 6.44657 9.237 5.03601 numMergedOcc 0
17 mol 287 unq 0 iso 0 dist 4.98604 7.22067 8.73403 7.95849 5.10722 9.76232 numMergedOcc 0
18 mol 288 unq 0 iso 0 dist 4.98604 7.22067 8.73403 7.95849 5.10722 9.76232 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 4.98604 7.22067 8.73403 7.95849 5.10722 9.76232 numMergedOcc 0
