0 mol 32 unq 0 iso 0 dist 8.89682 11.483 8.34024 15.9941 12.8992 7.18766 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 8.89682 11.483 8.34024 6.76514 8.39998 7.48825 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.17472 8.02212 8.82122 16.4615 15.3157 8.55901 numMergedOcc 0
3 mol 45 unq 0 iso 0 dist 5.90391 5.19805 6.94727 10.7365 11.5096 8.13782 numMergedOcc 0
4 mol 45 unq 1 iso 0 dist 8.82771 5.48117 6.94727 13.5781 11.5096 8.13782 numMergedOcc 0
5 mol 99 unq 0 iso 0 dist 8.23566 11.6733 8.15733 8.86001 5.17028 6.6925 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 9.21999 6.63186 8.33489 10.6753 14.7186 6.4218 numMergedOcc 0
7 mol 135 unq 0 iso 0 dist 7.54797 4.51614 9.16513 7.38478 5.50426 9.1005 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 9.17063 9.61315 9.25763 13.9484 5.56282 9.79554 numMergedOcc 0
9 mol 173 unq 1 iso 0 dist 9.99332 9.61315 9.63102 13.9484 7.17381 9.79554 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 7.2067 4.18777 6.84347 8.92139 8.65486 4.79852 numMergedOcc 0
11 mol 224 unq 0 iso 0 dist 7.7163 4.92261 8.60781 9.97425 5.46434 8.89778 numMergedOcc 0
12 mol 224 unq 1 iso 0 dist 7.7163 4.92261 8.60781 10.7344 5.03449 9.47554 numMergedOcc 0
13 mol 224 unq 2 iso 0 dist 9.06201 6.78064 8.60781 8.39753 5.46434 8.89778 numMergedOcc 0
14 mol 224 unq 3 iso 0 dist 9.06201 6.78064 8.60781 12.5544 5.03449 9.47554 numMergedOcc 0
15 mol 227 unq 0 iso 0 dist 7.99145 10.2228 8.34104 15.3735 9.63564 7.95168 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 8.8978 12.7871 8.79054 12.7765 13.0843 9.6101 numMergedOcc 0
17 mol 234 unq 1 iso 0 dist 8.8978 12.7871 8.79054 12.8613 6.7061 5.32183 numMergedOcc 0
18 mol 274 unq 0 iso 0 dist 7.24089 5.06637 5.42845 9.89613 4.05661 8.49866 numMergedOcc 0
19 mol 274 unq 1 iso 0 dist 9.29005 5.18671 5.42845 13.0653 4.05661 8.49866 numMergedOcc 0
20 mol 274 unq 2 iso 0 dist 8.16746 5.18671 5.62484 13.0653 7.47324 8.49866 numMergedOcc 0
21 mol 286 unq 0 iso 0 dist 8.30708 7.24769 9.10103 12.2194 11.1738 8.81794 numMergedOcc 0
22 mol 286 unq 1 iso 0 dist 8.9718 7.24769 6.88301 12.2194 5.6144 8.81794 numMergedOcc 0
