0 mol 55 unq 0 iso 0 dist 7.01944 6.83662 9.2881 10.795 8.0329 12.2554 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 8.61926 10.8544 9.14856 8.45243 7.7933 7.05519 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 8.84839 12.433 7.1249 9.38487 7.58673 14.5854 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 5.92974 5.27212 7.19209 10.5089 7.11852 7.94533 numMergedOcc 0
4 mol 133 unq 0 iso 0 dist 6.61636 8.08082 8.25207 8.13581 7.46812 14.4989 numMergedOcc 0
5 mol 147 unq 0 iso 0 dist 9.6818 4.93993 6.96704 9.82809 9.80032 9.20914 numMergedOcc 0
6 mol 173 unq 0 iso 0 dist 7.33162 15.6753 9.25763 5.19052 9.71921 18.0021 numMergedOcc 0
7 mol 173 unq 1 iso 0 dist 7.33162 16.6412 9.63102 5.19052 9.71921 17.8768 numMergedOcc 0
8 mol 217 unq 0 iso 0 dist 7.89936 5.21449 9.96798 3.6199 8.94871 6.24114 numMergedOcc 0
9 mol 224 unq 0 iso 0 dist 8.15582 6.4556 8.7868 6.16829 7.49889 11.5364 numMergedOcc 0
10 mol 224 unq 1 iso 0 dist 8.15582 5.66462 4.64336 6.16829 7.49889 6.88745 numMergedOcc 0
11 mol 228 unq 0 iso 0 dist 8.10816 6.74578 9.58356 14.3169 8.2286 16.9383 numMergedOcc 0
12 mol 228 unq 1 iso 0 dist 7.81837 16.0476 9.58356 7.4344 8.2286 16.9383 numMergedOcc 0
13 mol 228 unq 2 iso 0 dist 7.95486 6.68691 9.29522 14.5139 8.5965 17.1358 numMergedOcc 0
14 mol 228 unq 3 iso 0 dist 7.97746 16.1131 9.29522 7.20896 8.5965 17.1358 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 8.02916 5.77898 7.40408 13.6229 9.84931 11.2083 numMergedOcc 0
16 mol 239 unq 1 iso 0 dist 8.02916 10.2178 6.77395 13.6229 9.84931 9.33391 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 7.58405 11.3349 7.469 6.36561 5.85173 5.35596 numMergedOcc 0
18 mol 293 unq 0 iso 0 dist 8.93207 4.04746 7.59622 10.846 9.94817 6.80673 numMergedOcc 0
19 mol 293 unq 1 iso 0 dist 7.2668 8.09709 7.59622 13.0731 9.94817 6.80673 numMergedOcc 0
20 mol 293 unq 2 iso 0 dist 8.88355 10.8403 7.59622 11.8274 9.94817 6.80673 numMergedOcc 0
