0 mol 12 unq 0 iso 0 dist 4.85969 8.3933 4.60834 8.00085 6.91627 5.25583 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 7.7961 9.75898 15.9972 7.4373 8.60396 10.8842 numMergedOcc 0
2 mol 43 unq 1 iso 0 dist 7.7961 9.75898 15.9972 5.81652 7.48969 15.4291 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 7.73902 9.03899 4.0144 5.33887 7.98624 8.28079 numMergedOcc 0
4 mol 93 unq 0 iso 0 dist 4.45006 7.55854 4.1947 5.25364 8.52947 10.6424 numMergedOcc 0
5 mol 93 unq 1 iso 0 dist 4.45006 7.55854 4.1947 7.1496 8.84466 9.1246 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 9.00111 8.17621 3.87295 5.07153 4.87856 5.56645 numMergedOcc 0
7 mol 169 unq 0 iso 0 dist 8.11268 8.77324 14.4961 6.33958 8.56204 11.6006 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 6.46871 7.76428 5.07225 10.9673 7.76856 12.8296 numMergedOcc 0
9 mol 176 unq 0 iso 0 dist 8.85187 7.3134 13.4373 9.75201 9.84843 15.1614 numMergedOcc 0
10 mol 176 unq 1 iso 0 dist 9.44083 7.3134 8.07221 6.55581 9.60497 11.4454 numMergedOcc 0
11 mol 176 unq 2 iso 0 dist 7.0591 7.93501 8.07221 5.12864 9.60497 11.4454 numMergedOcc 0
12 mol 226 unq 0 iso 0 dist 9.31677 9.45587 4.31761 11.3876 6.17825 9.67948 numMergedOcc 0
13 mol 233 unq 0 iso 0 dist 7.55878 9.85333 11.8011 15.0896 9.49046 17.9799 numMergedOcc 0
14 mol 233 unq 1 iso 0 dist 7.55878 9.85333 11.8011 9.27865 7.24533 17.0807 numMergedOcc 0
15 mol 233 unq 2 iso 0 dist 4.91191 8.08374 5.89828 6.6982 9.49046 7.91999 numMergedOcc 0
16 mol 233 unq 3 iso 0 dist 4.91191 8.08374 5.89828 4.98124 7.24533 9.88832 numMergedOcc 0
17 mol 233 unq 4 iso 0 dist 4.91191 8.2689 8.98176 6.6982 9.49046 10.0396 numMergedOcc 0
18 mol 233 unq 5 iso 0 dist 4.91191 8.2689 8.98176 4.98124 7.24533 13.1937 numMergedOcc 0
19 mol 271 unq 0 iso 0 dist 9.27556 9.22385 9.86334 7.30325 8.74168 10.0882 numMergedOcc 0
20 mol 271 unq 1 iso 0 dist 9.27556 6.56531 5.60228 7.30325 8.74168 10.5057 numMergedOcc 0
21 mol 292 unq 0 iso 0 dist 8.99187 9.89794 11.7378 10.3947 5.76223 13.1507 numMergedOcc 0
