0 mol 20 unq 0 iso 0 dist 8.45518 5.88082 6.83357 8.46939 14.3246 8.65986 numMergedOcc 0
1 mol 20 unq 1 iso 0 dist 8.45518 5.88082 6.83357 7.27778 13.7531 9.39462 numMergedOcc 0
2 mol 20 unq 2 iso 0 dist 8.45518 5.35469 4.71011 8.46939 14.3246 9.74724 numMergedOcc 0
3 mol 20 unq 3 iso 0 dist 8.45518 5.35469 4.71011 7.27778 13.7531 9.13347 numMergedOcc 0
4 mol 33 unq 0 iso 0 dist 5.65377 7.77567 5.63669 6.82054 4.41045 8.45145 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 8.61203 7.91401 12.7497 4.29847 12.1183 9.60811 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 9.32172 6.88471 3.84261 9.49441 8.39335 9.86479 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 8.93486 8.19547 3.84261 5.15922 8.39335 9.86479 numMergedOcc 0
8 mol 123 unq 0 iso 0 dist 9.22679 5.87154 10.8296 6.45068 10.7712 8.24171 numMergedOcc 0
9 mol 123 unq 1 iso 0 dist 9.22679 6.82663 4.6864 6.45068 10.7712 6.63094 numMergedOcc 0
10 mol 176 unq 0 iso 0 dist 9.56967 8.8556 8.61203 7.95619 11.981 5.60333 numMergedOcc 0
11 mol 176 unq 1 iso 0 dist 9.56967 8.8556 8.61203 4.99447 9.7293 5.58647 numMergedOcc 0
12 mol 176 unq 2 iso 0 dist 9.56967 8.8556 8.61203 5.46526 13.4346 8.5733 numMergedOcc 0
13 mol 176 unq 3 iso 0 dist 7.66242 8.8556 5.73429 7.95619 9.74525 5.60333 numMergedOcc 0
14 mol 176 unq 4 iso 0 dist 7.66242 8.8556 5.73429 4.99447 8.00223 5.58647 numMergedOcc 0
15 mol 176 unq 5 iso 0 dist 7.66242 8.8556 5.73429 5.46526 9.60695 8.5733 numMergedOcc 0
16 mol 196 unq 0 iso 0 dist 7.21836 8.94535 9.74325 10.7769 9.91401 8.94198 numMergedOcc 0
17 mol 252 unq 0 iso 0 dist 6.4889 6.35781 3.63907 4.59672 10.3045 9.84342 numMergedOcc 0
18 mol 252 unq 1 iso 0 dist 6.4889 6.35781 3.63907 11.2225 10.4988 8.63893 numMergedOcc 0
19 mol 252 unq 2 iso 0 dist 6.4889 8.06117 5.6592 4.59672 10.3045 9.85159 numMergedOcc 0
20 mol 257 unq 0 iso 0 dist 8.548 7.89319 9.26193 6.04017 13.9663 9.16774 numMergedOcc 0
21 mol 257 unq 1 iso 0 dist 5.50393 7.89319 10.5349 6.04017 11.3288 9.16774 numMergedOcc 0
22 mol 257 unq 2 iso 0 dist 6.61807 7.89319 7.38093 6.04017 11.7797 9.16774 numMergedOcc 0
23 mol 283 unq 0 iso 0 dist 9.24924 5.34771 8.40497 5.91899 13.3954 9.74797 numMergedOcc 0
24 mol 283 unq 1 iso 0 dist 9.24924 5.34771 8.40497 8.2722 7.17276 9.90494 numMergedOcc 0
25 mol 283 unq 2 iso 0 dist 9.24924 9.2825 8.03948 8.2722 7.17276 5.90121 numMergedOcc 0
26 mol 283 unq 3 iso 0 dist 9.72248 9.40332 8.40497 8.32685 13.3954 9.74797 numMergedOcc 0
27 mol 283 unq 4 iso 0 dist 9.72248 9.40332 8.40497 5.93642 7.17276 9.90494 numMergedOcc 0
28 mol 283 unq 5 iso 0 dist 9.72248 5.8676 8.03948 5.93642 7.17276 5.90121 numMergedOcc 0
29 mol 287 unq 0 iso 0 dist 7.80478 7.86603 6.80232 10.0544 14.5005 8.70479 numMergedOcc 0
30 mol 288 unq 0 iso 0 dist 7.80478 7.86603 6.80232 10.0544 14.5005 8.70479 numMergedOcc 0
31 mol 289 unq 0 iso 0 dist 7.80478 7.86603 6.80232 10.0544 14.5005 8.70479 numMergedOcc 0
