0 mol 5 unq 0 iso 0 dist 9.68326 9.08586 7.44029 11.248 7.74636 11.6519 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.18111 8.83912 7.44029 13.8389 7.74636 11.6519 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 5.59847 7.4835 6.50001 13.2938 9.89425 9.80646 numMergedOcc 0
3 mol 13 unq 0 iso 0 dist 6.72878 4.19741 4.43066 10.6462 8.27119 10.6761 numMergedOcc 0
4 mol 41 unq 0 iso 0 dist 4.29713 7.70428 4.47883 7.22338 7.31718 8.86007 numMergedOcc 0
5 mol 41 unq 1 iso 0 dist 4.29713 7.70428 4.47883 5.36021 5.47447 4.87664 numMergedOcc 0
6 mol 41 unq 2 iso 0 dist 4.29713 10.1969 6.07514 7.22338 7.31718 9.57521 numMergedOcc 0
7 mol 41 unq 3 iso 0 dist 4.29713 10.1969 6.07514 5.36021 5.47447 10.2413 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 5.91019 11.8317 9.762 4.05022 4.27766 8.22845 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 5.32773 6.61244 6.12348 3.71942 4.30875 3.77247 numMergedOcc 0
10 mol 113 unq 1 iso 0 dist 5.32773 6.61244 6.12348 9.01611 8.65807 13.3539 numMergedOcc 0
11 mol 113 unq 2 iso 0 dist 5.32773 4.80164 7.2672 3.71942 4.30875 7.80142 numMergedOcc 0
12 mol 113 unq 3 iso 0 dist 5.32773 4.80164 7.2672 9.01611 8.65807 6.39991 numMergedOcc 0
13 mol 169 unq 0 iso 0 dist 5.30818 6.54652 6.27683 3.61063 4.11374 3.89732 numMergedOcc 0
14 mol 169 unq 1 iso 0 dist 5.30818 6.54652 6.27683 8.83987 8.37602 13.2558 numMergedOcc 0
15 mol 169 unq 2 iso 0 dist 5.30818 4.85063 7.1757 3.61063 4.11374 7.61664 numMergedOcc 0
16 mol 169 unq 3 iso 0 dist 5.30818 4.85063 7.1757 8.83987 8.37602 6.01622 numMergedOcc 0
17 mol 169 unq 4 iso 0 dist 9.70796 5.11121 8.54444 7.64279 8.93091 9.63929 numMergedOcc 0
18 mol 169 unq 5 iso 0 dist 8.89822 14.3008 6.27683 12.9917 4.11374 3.89732 numMergedOcc 0
19 mol 169 unq 6 iso 0 dist 8.89822 14.3008 6.27683 12.2955 8.37602 13.2558 numMergedOcc 0
20 mol 169 unq 7 iso 0 dist 8.89822 12.1929 7.1757 12.9917 4.11374 7.61664 numMergedOcc 0
21 mol 169 unq 8 iso 0 dist 8.89822 12.1929 7.1757 12.2955 8.37602 6.01622 numMergedOcc 0
22 mol 184 unq 0 iso 0 dist 8.09403 3.76321 8.27396 9.24858 5.23187 9.10254 numMergedOcc 0
23 mol 193 unq 0 iso 0 dist 5.06367 4.30951 7.85801 9.34378 6.94187 11.9413 numMergedOcc 0
24 mol 233 unq 0 iso 0 dist 6.0751 3.73772 5.76164 5.31235 8.4338 4.45501 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 7.12723 9.78456 8.27917 8.32005 4.27826 7.01472 numMergedOcc 0
26 mol 285 unq 1 iso 0 dist 7.12723 9.78456 8.27917 7.07384 5.82074 11.0045 numMergedOcc 0
