0 mol 18 unq 0 iso 0 dist 9.2978 8.25905 5.01478 5.13088 9.55948 11.0147 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 8.90024 7.84444 12.2025 14.6778 8.03754 18.1598 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 6.78532 7.84444 7.68348 5.9674 9.47348 12.2549 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 6.77833 8.06918 6.65811 5.81368 9.74802 6.22308 numMergedOcc 0
4 mol 70 unq 1 iso 0 dist 6.77833 7.52623 5.47516 5.81368 9.74802 7.0495 numMergedOcc 0
5 mol 70 unq 2 iso 0 dist 6.77833 5.62294 11.0952 5.81368 9.74802 10.2795 numMergedOcc 0
6 mol 70 unq 3 iso 0 dist 9.83265 8.56968 6.65811 3.88245 9.74802 6.22308 numMergedOcc 0
7 mol 70 unq 4 iso 0 dist 9.83265 7.31655 5.47516 3.88245 9.74802 7.0495 numMergedOcc 0
8 mol 70 unq 5 iso 0 dist 9.83265 7.99569 11.0952 3.88245 9.74802 10.2795 numMergedOcc 0
9 mol 122 unq 0 iso 0 dist 8.47907 9.55337 5.41882 14.9119 8.75778 13.4235 numMergedOcc 0
10 mol 126 unq 0 iso 0 dist 7.02525 6.35364 5.15767 10.7956 7.44723 8.62574 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 8.66715 4.95674 12.0863 16.6927 9.1146 19.324 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 8.95433 9.59094 4.68409 4.42593 9.1146 7.46812 numMergedOcc 0
13 mol 154 unq 0 iso 0 dist 7.34207 5.81632 6.53652 6.84292 6.36439 10.3914 numMergedOcc 0
14 mol 167 unq 0 iso 0 dist 6.53913 9.4422 6.58937 13.5763 9.23645 11.5728 numMergedOcc 0
15 mol 178 unq 0 iso 0 dist 8.04723 5.85439 5.25267 8.33307 9.63185 11.873 numMergedOcc 0
16 mol 187 unq 0 iso 0 dist 9.38169 9.25105 6.62321 9.61673 6.82787 12.2628 numMergedOcc 0
17 mol 197 unq 0 iso 0 dist 6.18446 6.58245 5.2908 4.80458 8.67786 8.4273 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 6.48196 7.99897 8.96098 4.26152 7.41931 12.0539 numMergedOcc 0
19 mol 236 unq 0 iso 0 dist 9.07222 7.05868 8.192 7.3073 6.43046 10.8605 numMergedOcc 0
20 mol 236 unq 1 iso 0 dist 9.09998 7.05868 6.90372 5.05395 9.79948 9.33734 numMergedOcc 0
21 mol 267 unq 0 iso 0 dist 7.94474 6.87713 7.11419 4.50603 9.44648 10.2993 numMergedOcc 0
22 mol 277 unq 0 iso 0 dist 9.38793 9.28545 17.5025 9.78665 6.03235 18.9689 numMergedOcc 0
