0 mol 34 unq 0 iso 0 dist 8.65429 13.0088 9.31883 19.5739 14.9872 8.63361 13.9848 9.92713 6.15801 5.89577 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 8.65429 13.0088 9.31883 19.5739 14.9872 8.63361 17.2283 15.7295 9.63403 6.62645 numMergedOcc 0
2 mol 34 unq 2 iso 0 dist 8.65429 13.0088 9.31883 19.5739 14.9872 8.63361 20.9988 16.4972 8.07314 6.27366 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.14547 5.32605 7.66942 7.99116 4.53496 8.58543 11.5958 15.0139 7.62738 15.4757 numMergedOcc 0
4 mol 141 unq 0 iso 0 dist 9.80185 12.6656 8.88454 8.55099 5.50466 8.93453 11.8903 3.80087 9.78667 9.21506 numMergedOcc 0
5 mol 141 unq 1 iso 0 dist 9.80185 12.6656 8.88454 8.55099 5.50466 8.93453 7.35385 3.80763 6.73983 4.38393 numMergedOcc 0
6 mol 141 unq 2 iso 0 dist 9.80185 12.6656 8.88454 8.55099 5.50466 8.93453 8.35864 9.98068 7.64956 6.06881 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 8.78397 5.77969 5.42715 12.2427 4.78989 8.60521 5.11444 5.83776 5.06613 7.72754 numMergedOcc 0
8 mol 156 unq 0 iso 0 dist 9.15935 8.41671 5.22104 12.5665 6.69196 5.90883 10.0516 5.64188 7.46845 11.3995 numMergedOcc 0
9 mol 156 unq 1 iso 0 dist 9.15935 8.41671 5.22104 15.6273 7.91467 8.06913 10.0516 5.64188 7.46845 11.6326 numMergedOcc 0
10 mol 156 unq 2 iso 0 dist 8.24388 6.88531 5.22104 8.60938 6.69196 5.90883 11.8338 5.64188 7.46845 11.3995 numMergedOcc 0
11 mol 156 unq 3 iso 0 dist 8.24388 6.88531 5.22104 12.4306 7.91467 8.06913 11.8338 5.64188 7.46845 11.6326 numMergedOcc 0
12 mol 186 unq 0 iso 0 dist 7.005 8.99916 8.46395 9.99867 9.42515 7.23293 9.53805 5.39534 5.45675 5.91678 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 9.60788 12.5181 5.78717 14.4579 10.0237 5.52678 13.5935 7.29209 6.37788 5.92931 numMergedOcc 0
14 mol 237 unq 0 iso 0 dist 5.12878 5.91026 7.95072 9.82325 8.49326 7.63812 11.2533 11.9967 6.07878 11.0622 numMergedOcc 0
15 mol 237 unq 1 iso 0 dist 5.12878 5.91026 7.95072 9.82325 8.49326 7.63812 11.4777 9.68512 7.80422 9.12884 numMergedOcc 0
16 mol 237 unq 2 iso 0 dist 5.12878 5.91026 7.95072 9.82325 8.49326 7.63812 5.62039 3.68966 5.06628 6.26206 numMergedOcc 0
17 mol 237 unq 3 iso 0 dist 5.12878 5.91026 7.95072 9.33252 5.41814 8.51129 11.2533 11.9967 6.07878 10.1757 numMergedOcc 0
18 mol 237 unq 4 iso 0 dist 5.12878 5.91026 7.95072 9.33252 5.41814 8.51129 11.4777 9.68512 7.80422 5.77883 numMergedOcc 0
19 mol 237 unq 5 iso 0 dist 5.12878 5.91026 7.95072 9.33252 5.41814 8.51129 5.62039 3.68966 5.06628 3.97854 numMergedOcc 0
20 mol 252 unq 0 iso 0 dist 6.71152 11.2901 8.38453 18.3994 14.8966 8.55481 10.3055 3.99887 7.39391 12.0545 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 7.30584 8.01289 4.64695 10.0614 4.05076 8.3149 14.3879 7.28821 7.99521 7.16782 numMergedOcc 0
