0 mol 10 unq 0 iso 0 dist 7.57901 9.05199 8.44864 5.76822 9.43029 4.87706 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 6.05244 11.812 9.25493 10.7889 9.90835 3.92728 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.69142 7.54726 9.27369 4.18634 6.07276 5.23054 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 9.01993 14.7592 8.99751 6.14353 9.36924 13.4787 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 9.01993 15.6317 9.30674 6.14353 9.36924 12.9136 numMergedOcc 0
5 mol 26 unq 3 iso 0 dist 9.01993 14.4804 8.25567 6.14353 9.36924 10.8015 numMergedOcc 0
6 mol 26 unq 4 iso 0 dist 8.43523 12.5131 9.27369 12.7209 6.07276 5.23054 numMergedOcc 0
7 mol 68 unq 0 iso 0 dist 6.27321 5.16912 7.07989 3.62638 7.98985 6.4113 numMergedOcc 0
8 mol 68 unq 1 iso 0 dist 6.27321 14.5387 9.77272 3.62638 7.98985 16.2411 numMergedOcc 0
9 mol 112 unq 0 iso 0 dist 9.86487 6.92638 5.42828 4.9759 8.72725 3.61827 numMergedOcc 0
10 mol 112 unq 1 iso 0 dist 9.86487 6.92638 5.42828 6.59976 6.11407 3.78964 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 8.49444 4.77108 9.66068 9.55465 9.30645 8.60362 numMergedOcc 0
12 mol 128 unq 0 iso 0 dist 4.89256 4.9915 6.03154 6.15201 9.59437 5.94952 numMergedOcc 0
13 mol 135 unq 0 iso 0 dist 5.95344 8.06979 5.43728 11.4432 7.28318 5.46698 numMergedOcc 0
14 mol 135 unq 1 iso 0 dist 7.8687 6.64028 5.43728 11.8717 7.28318 5.46698 numMergedOcc 0
15 mol 146 unq 0 iso 0 dist 6.75663 6.31044 8.09482 4.84029 9.10637 5.40923 numMergedOcc 0
16 mol 154 unq 0 iso 0 dist 5.57798 9.67496 7.08477 4.78116 5.2693 5.18463 numMergedOcc 0
17 mol 169 unq 0 iso 0 dist 5.77897 6.54652 5.51388 12.1541 9.15283 14.6592 numMergedOcc 0
18 mol 169 unq 1 iso 0 dist 5.77897 5.13324 8.17917 12.1541 9.15283 13.7799 numMergedOcc 0
19 mol 169 unq 2 iso 0 dist 5.77897 4.85063 8.68909 12.1541 9.15283 11.1071 numMergedOcc 0
20 mol 169 unq 3 iso 0 dist 9.71763 14.3008 5.51388 6.43144 9.15283 14.6592 numMergedOcc 0
21 mol 169 unq 4 iso 0 dist 9.71763 16.5605 8.17917 6.43144 9.15283 13.7799 numMergedOcc 0
22 mol 169 unq 5 iso 0 dist 9.71763 12.1929 8.68909 6.43144 9.15283 11.1071 numMergedOcc 0
23 mol 184 unq 0 iso 0 dist 6.71675 3.76321 8.95598 8.04827 7.81263 6.60692 numMergedOcc 0
24 mol 225 unq 0 iso 0 dist 7.51337 13.8982 9.79381 4.36059 6.94762 11.9758 numMergedOcc 0
25 mol 225 unq 1 iso 0 dist 7.51337 13.8982 9.79381 14.1026 9.89167 3.69148 numMergedOcc 0
26 mol 225 unq 2 iso 0 dist 7.51337 14.2286 8.37379 4.36059 6.94762 12.7552 numMergedOcc 0
27 mol 225 unq 3 iso 0 dist 7.51337 14.2286 8.37379 14.1026 9.89167 5.69755 numMergedOcc 0
28 mol 236 unq 0 iso 0 dist 5.27184 5.05085 8.37813 4.51728 6.15635 5.45156 numMergedOcc 0
29 mol 236 unq 1 iso 0 dist 5.27184 5.9703 9.14116 4.51728 6.15635 4.88971 numMergedOcc 0
30 mol 256 unq 0 iso 0 dist 5.58036 7.35186 5.66817 5.52853 6.85663 8.00048 numMergedOcc 0
31 mol 260 unq 0 iso 0 dist 4.76698 9.30964 5.68717 4.87707 6.75725 9.0549 numMergedOcc 0
32 mol 260 unq 1 iso 0 dist 4.76698 9.30964 5.68717 14.0463 9.31888 6.73886 numMergedOcc 0
33 mol 273 unq 0 iso 0 dist 6.59092 13.9951 9.78826 4.3735 5.61969 13.255 numMergedOcc 0
34 mol 278 unq 0 iso 0 dist 6.9592 4.46246 6.81257 5.90283 9.03998 3.86293 numMergedOcc 0
