0 mol 21 unq 0 iso 0 dist 8.07914 5.0018 3.91407 7.30688 10.1117 8.64046 numMergedOcc 0
1 mol 21 unq 1 iso 0 dist 8.07914 5.0018 3.91407 6.70786 9.53082 9.1215 numMergedOcc 0
2 mol 21 unq 2 iso 0 dist 8.07914 5.0018 3.91407 8.16395 9.20888 9.60455 numMergedOcc 0
3 mol 29 unq 0 iso 0 dist 7.50258 5.94216 11.6887 6.04161 5.97852 7.075 numMergedOcc 0
4 mol 33 unq 0 iso 0 dist 8.04019 7.03174 11.7029 7.82815 3.85975 9.74845 numMergedOcc 0
5 mol 33 unq 1 iso 0 dist 7.44828 7.03174 5.34698 7.82815 13.4442 9.74845 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 9.06142 8.91502 9.93163 6.34748 9.83589 12.4187 numMergedOcc 0
7 mol 56 unq 1 iso 0 dist 9.06142 8.91502 9.93163 8.25594 13.3076 5.6898 numMergedOcc 0
8 mol 56 unq 2 iso 0 dist 8.41264 8.91502 4.5508 6.34748 12.3293 12.4187 numMergedOcc 0
9 mol 56 unq 3 iso 0 dist 8.41264 8.91502 4.5508 8.25594 9.40102 5.6898 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 9.96635 7.41387 4.1393 9.53944 5.47558 3.54696 numMergedOcc 0
11 mol 162 unq 0 iso 0 dist 6.59407 9.98649 8.04855 6.51243 3.95884 10.533 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 6.38335 7.76901 8.70351 5.61979 5.2973 9.03811 numMergedOcc 0
13 mol 182 unq 1 iso 0 dist 6.38335 9.80892 6.2072 5.61979 5.2973 8.58849 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.2254 5.84716 14.6234 5.27578 12.8633 4.4877 numMergedOcc 0
15 mol 192 unq 0 iso 0 dist 9.69055 9.99252 13.4977 9.63224 5.41626 9.64278 numMergedOcc 0
16 mol 192 unq 1 iso 0 dist 9.69055 9.99252 13.4977 6.98794 3.98653 10.8255 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 5.86839 9.49617 7.96379 6.50586 3.73699 8.16419 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 6.39087 8.01243 9.77953 8.63649 4.4227 7.98284 numMergedOcc 0
19 mol 220 unq 1 iso 0 dist 6.39087 9.55264 12.8065 8.63649 4.4227 15.7445 numMergedOcc 0
20 mol 286 unq 0 iso 0 dist 6.83763 9.09717 8.40229 6.64391 3.67621 9.05435 numMergedOcc 0
