0 mol 24 unq 0 iso 0 dist 5.78238 9.82272 9.41655 6.14082 6.803 4.10458 numMergedOcc 0
1 mol 24 unq 0 iso 1 dist 5.78238 6.14082 6.803 9.82272 9.41655 4.10458 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 5.19692 9.86665 7.78893 10.4845 5.85146 9.19346 numMergedOcc 0
3 mol 30 unq 0 iso 1 dist 5.19692 10.4845 5.85146 9.86665 7.78893 9.19346 numMergedOcc 0
4 mol 34 unq 0 iso 0 dist 4.75558 13.9794 9.31883 13.6396 9.475 3.56021 numMergedOcc 0
5 mol 34 unq 0 iso 1 dist 4.75558 13.6396 9.475 13.9794 9.31883 3.56021 numMergedOcc 0
6 mol 34 unq 1 iso 0 dist 4.75558 13.9794 9.31883 12.4215 8.34011 5.8452 numMergedOcc 0
7 mol 34 unq 1 iso 1 dist 4.75558 12.4215 8.34011 13.9794 9.31883 5.8452 numMergedOcc 0
8 mol 34 unq 2 iso 0 dist 4.75558 13.9794 9.31883 4.96488 6.29842 14.6218 numMergedOcc 0
9 mol 34 unq 2 iso 1 dist 4.75558 4.96488 6.29842 13.9794 9.31883 14.6218 numMergedOcc 0
10 mol 34 unq 1 iso 0 dist 4.75558 13.6396 9.475 12.4215 8.34011 5.86087 numMergedOcc 0
11 mol 34 unq 1 iso 1 dist 4.75558 12.4215 8.34011 13.6396 9.475 5.86087 numMergedOcc 0
12 mol 34 unq 2 iso 0 dist 4.75558 13.6396 9.475 4.96488 6.29842 14.7594 numMergedOcc 0
13 mol 34 unq 2 iso 1 dist 4.75558 4.96488 6.29842 13.6396 9.475 14.7594 numMergedOcc 0
14 mol 34 unq 2 iso 0 dist 4.75558 12.4215 8.34011 4.96488 6.29842 11.4891 numMergedOcc 0
15 mol 34 unq 2 iso 1 dist 4.75558 4.96488 6.29842 12.4215 8.34011 11.4891 numMergedOcc 0
16 mol 48 unq 0 iso 0 dist 8.81611 7.64845 5.54554 14.8695 6.84514 8.33924 numMergedOcc 0
17 mol 48 unq 0 iso 1 dist 8.81611 14.8695 6.84514 7.64845 5.54554 8.33924 numMergedOcc 0
18 mol 48 unq 1 iso 0 dist 8.81611 7.64845 5.54554 11.3732 8.95402 6.91279 numMergedOcc 0
19 mol 48 unq 1 iso 1 dist 8.81611 11.3732 8.95402 7.64845 5.54554 6.91279 numMergedOcc 0
20 mol 48 unq 1 iso 0 dist 8.81611 14.8695 6.84514 11.3732 8.95402 10.0905 numMergedOcc 0
21 mol 48 unq 1 iso 1 dist 8.81611 11.3732 8.95402 14.8695 6.84514 10.0905 numMergedOcc 0
22 mol 48 unq 2 iso 0 dist 7.09356 6.94072 5.54554 8.28032 6.84514 8.33924 numMergedOcc 0
23 mol 48 unq 2 iso 1 dist 7.09356 8.28032 6.84514 6.94072 5.54554 8.33924 numMergedOcc 0
24 mol 48 unq 3 iso 0 dist 7.09356 6.94072 5.54554 13.284 8.95402 6.91279 numMergedOcc 0
25 mol 48 unq 3 iso 1 dist 7.09356 13.284 8.95402 6.94072 5.54554 6.91279 numMergedOcc 0
26 mol 48 unq 3 iso 0 dist 7.09356 8.28032 6.84514 13.284 8.95402 10.0905 numMergedOcc 0
27 mol 48 unq 3 iso 1 dist 7.09356 13.284 8.95402 8.28032 6.84514 10.0905 numMergedOcc 0
28 mol 48 unq 4 iso 0 dist 8.81414 8.09295 5.5232 15.2448 7.05619 8.45701 numMergedOcc 0
29 mol 48 unq 4 iso 1 dist 8.81414 15.2448 7.05619 8.09295 5.5232 8.45701 numMergedOcc 0
30 mol 48 unq 5 iso 0 dist 7.00226 7.11454 5.5232 8.60738 7.05619 8.45701 numMergedOcc 0
31 mol 48 unq 5 iso 1 dist 7.00226 8.60738 7.05619 7.11454 5.5232 8.45701 numMergedOcc 0
32 mol 55 unq 0 iso 0 dist 6.05701 9.17803 8.9899 11.7107 8.45058 5.43051 numMergedOcc 0
33 mol 55 unq 0 iso 1 dist 6.05701 11.7107 8.45058 9.17803 8.9899 5.43051 numMergedOcc 0
34 mol 55 unq 1 iso 0 dist 6.05701 9.17803 8.9899 4.98995 7.73542 4.78168 numMergedOcc 0
35 mol 55 unq 1 iso 1 dist 6.05701 4.98995 7.73542 9.17803 8.9899 4.78168 numMergedOcc 0
36 mol 55 unq 1 iso 0 dist 6.05701 11.7107 8.45058 4.98995 7.73542 8.93213 numMergedOcc 0
37 mol 55 unq 1 iso 1 dist 6.05701 4.98995 7.73542 11.7107 8.45058 8.93213 numMergedOcc 0
38 mol 73 unq 0 iso 0 dist 9.23537 11.4114 8.59337 15.0963 7.66942 8.86418 numMergedOcc 0
39 mol 73 unq 0 iso 1 dist 9.23537 15.0963 7.66942 11.4114 8.59337 8.86418 numMergedOcc 0
40 mol 141 unq 0 iso 0 dist 5.96907 4.20944 5.4206 6.685 9.56763 5.71798 numMergedOcc 0
41 mol 141 unq 0 iso 1 dist 5.96907 6.685 9.56763 4.20944 5.4206 5.71798 numMergedOcc 0
42 mol 143 unq 0 iso 0 dist 6.63984 5.96417 8.56866 11.167 5.66207 10.0717 numMergedOcc 0
43 mol 143 unq 0 iso 1 dist 6.63984 11.167 5.66207 5.96417 8.56866 10.0717 numMergedOcc 0
44 mol 186 unq 0 iso 0 dist 8.83254 8.78296 7.88501 9.60871 9.09585 7.59605 numMergedOcc 0
45 mol 186 unq 0 iso 1 dist 8.83254 9.60871 9.09585 8.78296 7.88501 7.59605 numMergedOcc 0
46 mol 218 unq 0 iso 0 dist 9.71415 10.0574 6.62738 4.56488 7.13254 5.51725 numMergedOcc 0
47 mol 218 unq 0 iso 1 dist 9.71415 4.56488 7.13254 10.0574 6.62738 5.51725 numMergedOcc 0
48 mol 230 unq 0 iso 0 dist 5.51163 10.1123 7.83105 10.6497 5.63025 9.60716 numMergedOcc 0
49 mol 230 unq 0 iso 1 dist 5.51163 10.6497 5.63025 10.1123 7.83105 9.60716 numMergedOcc 0
50 mol 255 unq 0 iso 0 dist 6.86437 12.3106 8.56885 4.56113 5.54361 9.13933 numMergedOcc 0
51 mol 255 unq 0 iso 1 dist 6.86437 4.56113 5.54361 12.3106 8.56885 9.13933 numMergedOcc 0
52 mol 255 unq 1 iso 0 dist 6.86437 12.3106 8.56885 7.01955 7.73503 16.0238 numMergedOcc 0
53 mol 255 unq 1 iso 1 dist 6.86437 7.01955 7.73503 12.3106 8.56885 16.0238 numMergedOcc 0
54 mol 255 unq 1 iso 0 dist 6.86437 4.56113 5.54361 7.01955 7.73503 8.80381 numMergedOcc 0
55 mol 255 unq 1 iso 1 dist 6.86437 7.01955 7.73503 4.56113 5.54361 8.80381 numMergedOcc 0
