0 mol 1 unq 0 iso 0 dist 5.87976 9.48433 6.35409 7.58747 7.81034 13.5574 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 5.87976 9.48433 6.35409 6.38325 9.19497 14.3713 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 8.07638 8.85981 8.60018 4.49648 8.73093 6.4104 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 8.07638 8.85981 8.60018 4.50556 9.1622 12.0834 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 8.07638 9.37314 5.96946 4.49648 8.73093 10.1769 numMergedOcc 0
5 mol 73 unq 3 iso 0 dist 8.07638 9.37314 5.96946 4.50556 9.1622 9.85884 numMergedOcc 0
6 mol 73 unq 4 iso 0 dist 6.79787 8.85981 7.06343 4.49648 8.02104 6.4104 numMergedOcc 0
7 mol 73 unq 5 iso 0 dist 6.79787 8.85981 7.06343 4.50556 7.59013 12.0834 numMergedOcc 0
8 mol 73 unq 6 iso 0 dist 6.79787 9.37314 3.27963 4.49648 8.02104 10.1769 numMergedOcc 0
9 mol 73 unq 7 iso 0 dist 6.79787 9.37314 3.27963 4.50556 7.59013 9.85884 numMergedOcc 0
10 mol 76 unq 0 iso 0 dist 8.76383 5.17291 7.19147 5.8454 7.5434 5.91259 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 4.76012 6.1421 6.43966 7.37866 5.16531 11.3588 numMergedOcc 0
12 mol 147 unq 0 iso 0 dist 8.94007 9.11046 6.91778 12.2068 5.47265 9.88662 numMergedOcc 0
13 mol 170 unq 0 iso 0 dist 9.2621 7.47249 7.71028 6.16238 9.05865 9.32245 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 8.91036 9.72828 10.8336 14.4364 6.60418 16.0123 numMergedOcc 0
15 mol 197 unq 0 iso 0 dist 8.05227 7.18765 7.56497 5.71227 7.32228 8.67786 numMergedOcc 0
16 mol 197 unq 1 iso 0 dist 8.05227 7.41091 5.66137 5.71227 7.32228 10.1566 numMergedOcc 0
17 mol 222 unq 0 iso 0 dist 6.17749 8.81925 4.82768 4.56851 4.87053 8.86173 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 8.73545 4.94074 6.52848 4.67806 8.01777 7.41931 numMergedOcc 0
19 mol 234 unq 0 iso 0 dist 9.72222 9.70004 17.3839 11.6551 9.63004 17.432 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 9.44043 8.14812 9.07364 11.1283 5.9223 11.1621 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 5.83023 5.37894 4.84657 4.69901 8.99435 6.03235 numMergedOcc 0
