0 mol 5 unq 0 iso 0 dist 5.2392 4.9568 3.33561 4.42081 9.22027 7.56229 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.54508 7.79911 3.33439 10.0857 11.8224 9.58192 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 7.30651 7.25138 5.98227 5.56988 9.53846 7.16844 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 6.63973 6.46582 3.35924 11.3491 10.8507 9.57759 numMergedOcc 0
4 mol 78 unq 0 iso 0 dist 9.05414 6.73466 3.12289 3.44873 11.8094 9.38837 numMergedOcc 0
5 mol 78 unq 1 iso 0 dist 9.05414 6.73466 3.12289 10.3854 12.611 9.80913 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 8.59739 7.06029 5.70329 10.0025 13.629 9.04293 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 8.59739 7.06029 5.70329 6.35003 10.0103 4.78333 numMergedOcc 0
8 mol 169 unq 0 iso 0 dist 6.27683 7.33643 3.59996 14.6592 10.2894 9.06172 numMergedOcc 0
9 mol 169 unq 1 iso 0 dist 6.27683 7.33643 3.59996 14.9735 11.3115 8.93091 numMergedOcc 0
10 mol 169 unq 2 iso 0 dist 6.00783 7.50458 9.60496 6.22697 11.3821 7.65903 numMergedOcc 0
11 mol 169 unq 3 iso 0 dist 6.00783 5.79554 10.5251 6.22697 11.3821 5.97653 numMergedOcc 0
12 mol 169 unq 4 iso 0 dist 6.00783 4.22003 8.67112 6.22697 11.3821 7.75523 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 8.27396 9.10344 3.30691 6.60692 4.61596 7.25623 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.18289 6.99587 4.97041 3.6848 10.4988 9.17458 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 9.18289 6.99587 4.97041 5.33968 5.67168 6.94594 numMergedOcc 0
16 mol 186 unq 2 iso 0 dist 9.18289 4.37577 6.50779 3.6848 10.4988 7.36794 numMergedOcc 0
17 mol 186 unq 3 iso 0 dist 9.18289 4.37577 6.50779 5.33968 5.67168 5.81881 numMergedOcc 0
18 mol 186 unq 4 iso 0 dist 6.52441 6.99587 4.75583 3.6848 9.98715 9.17458 numMergedOcc 0
19 mol 186 unq 5 iso 0 dist 6.52441 6.99587 4.75583 5.33968 8.39342 6.94594 numMergedOcc 0
20 mol 186 unq 6 iso 0 dist 6.52441 4.37577 3.11607 3.6848 9.98715 7.36794 numMergedOcc 0
21 mol 186 unq 7 iso 0 dist 6.52441 4.37577 3.11607 5.33968 8.39342 5.81881 numMergedOcc 0
22 mol 186 unq 8 iso 0 dist 6.26168 6.99587 5.53349 3.6848 8.5672 9.17458 numMergedOcc 0
23 mol 186 unq 9 iso 0 dist 6.26168 6.99587 5.53349 5.33968 9.83496 6.94594 numMergedOcc 0
24 mol 186 unq 10 iso 0 dist 6.26168 4.37577 4.65666 3.6848 8.5672 7.36794 numMergedOcc 0
25 mol 186 unq 11 iso 0 dist 6.26168 4.37577 4.65666 5.33968 9.83496 5.81881 numMergedOcc 0
26 mol 205 unq 0 iso 0 dist 6.41148 8.93485 6.49396 6.10058 5.03818 7.68686 numMergedOcc 0
27 mol 205 unq 1 iso 0 dist 5.06713 5.66636 6.49396 3.50446 5.03818 7.68686 numMergedOcc 0
28 mol 205 unq 2 iso 0 dist 8.69512 5.66636 8.93955 3.50446 6.40171 7.68686 numMergedOcc 0
29 mol 222 unq 0 iso 0 dist 8.86886 4.90656 10.1968 4.91709 8.14294 8.88902 numMergedOcc 0
30 mol 255 unq 0 iso 0 dist 7.7177 7.80616 3.76507 5.98092 10.9778 8.7958 numMergedOcc 0
31 mol 278 unq 0 iso 0 dist 9.54428 9.93392 3.20775 3.86293 10.5144 9.67239 numMergedOcc 0
32 mol 285 unq 0 iso 0 dist 8.27917 6.73396 3.14843 6.01574 10.4537 7.73438 numMergedOcc 0
