0 mol 26 unq 0 iso 0 dist 6.93801 6.91195 9.72597 6.61393 7.90721 5.7075 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 6.78356 5.81148 9.01516 11.5077 5.07125 13.6231 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 6.78356 8.85692 7.31255 11.5077 5.07125 8.33154 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.91206 14.1204 8.0534 13.1036 7.69861 11.5328 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 8.67513 15.8898 8.0534 7.16384 7.69861 11.5328 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 5.14178 8.57218 8.89951 4.93697 5.17145 4.69408 numMergedOcc 0
6 mol 74 unq 0 iso 0 dist 9.4866 11.1303 9.60205 7.39752 6.3567 11.588 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.84146 9.96709 7.20629 15.9454 9.6121 9.24957 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 8.84146 9.96709 7.20629 17.7274 9.57341 12.6962 numMergedOcc 0
9 mol 126 unq 0 iso 0 dist 7.68174 13.0938 9.31118 5.11016 8.66815 10.1006 numMergedOcc 0
10 mol 126 unq 1 iso 0 dist 7.68174 4.63152 8.44104 5.11016 8.66815 5.08006 numMergedOcc 0
11 mol 173 unq 0 iso 0 dist 4.0037 8.73632 8.44479 9.37239 7.17037 6.21272 numMergedOcc 0
12 mol 173 unq 1 iso 0 dist 4.0037 12.6081 9.00002 9.37239 7.17037 10.8086 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 4.97005 9.36078 5.31166 10.2673 8.57801 6.3473 numMergedOcc 0
14 mol 222 unq 0 iso 0 dist 9.04499 15.0661 7.11989 12.9462 7.97027 11.0888 numMergedOcc 0
15 mol 222 unq 1 iso 0 dist 9.04499 15.0661 7.11989 11.0561 6.81955 5.93092 numMergedOcc 0
16 mol 222 unq 2 iso 0 dist 9.04499 15.0661 7.11989 9.50604 4.9876 6.80198 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 8.84798 16.3239 7.84195 14.4305 5.8304 5.03747 numMergedOcc 0
18 mol 279 unq 1 iso 0 dist 8.84798 16.3239 7.84195 6.08238 7.37478 14.9354 numMergedOcc 0
19 mol 279 unq 2 iso 0 dist 8.84798 12.5605 9.2174 14.4305 5.8304 9.59972 numMergedOcc 0
20 mol 279 unq 3 iso 0 dist 8.84798 12.5605 9.2174 6.08238 7.37478 6.63427 numMergedOcc 0
21 mol 279 unq 4 iso 0 dist 7.5355 4.77763 5.65882 4.91802 5.81528 5.03816 numMergedOcc 0
22 mol 279 unq 5 iso 0 dist 7.88343 5.44699 5.65882 9.35656 5.81528 5.03816 numMergedOcc 0
