0 mol 4 unq 0 iso 0 dist 8.67981 11.5212 6.12485 13.6868 5.52224 8.81559 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 9.1125 4.55975 8.03458 13.1091 6.61479 9.88507 numMergedOcc 0
2 mol 12 unq 0 iso 0 dist 4.62913 4.60834 6.6051 9.61179 7.81704 6.6691 numMergedOcc 0
3 mol 12 unq 1 iso 0 dist 4.62913 4.60834 6.6051 12.4366 11.1322 9.23807 numMergedOcc 0
4 mol 12 unq 2 iso 0 dist 4.62913 4.60834 6.6051 10.451 13.5603 9.52857 numMergedOcc 0
5 mol 12 unq 3 iso 0 dist 7.44542 4.60834 8.15864 9.61179 12.0704 6.6691 numMergedOcc 0
6 mol 12 unq 4 iso 0 dist 7.44542 4.60834 8.15864 12.4366 12.4138 9.23807 numMergedOcc 0
7 mol 12 unq 5 iso 0 dist 7.44542 4.60834 8.15864 10.451 4.40652 9.52857 numMergedOcc 0
8 mol 33 unq 0 iso 0 dist 8.41842 10.1727 7.44828 16.2018 13.6327 9.8482 numMergedOcc 0
9 mol 48 unq 0 iso 0 dist 8.05728 9.57046 9.40644 13.2631 11.0398 7.66163 numMergedOcc 0
10 mol 48 unq 1 iso 0 dist 8.05728 4.91237 5.35252 13.2631 11.0398 9.48288 numMergedOcc 0
11 mol 79 unq 0 iso 0 dist 8.01516 15.8477 8.64686 16.2527 8.69896 5.33546 numMergedOcc 0
12 mol 103 unq 0 iso 0 dist 7.52954 6.78021 6.56481 15.2446 9.47975 9.50699 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 9.34752 10.0813 5.2184 11.519 4.96177 7.89317 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 8.41858 4.62337 5.2184 11.6237 4.96177 7.89317 numMergedOcc 0
15 mol 123 unq 0 iso 0 dist 7.15869 8.29205 9.92281 11.3177 11.1697 8.70616 numMergedOcc 0
16 mol 124 unq 0 iso 0 dist 9.7589 7.73112 7.18976 16.855 10.1583 9.5436 numMergedOcc 0
17 mol 129 unq 0 iso 0 dist 7.13958 4.74644 7.6453 12.7577 8.73165 9.7113 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 7.55333 6.67537 5.86839 10.5525 8.3451 9.37516 numMergedOcc 0
19 mol 220 unq 0 iso 0 dist 8.55805 4.74145 6.39087 6.32097 5.45485 5.75839 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 8.20542 4.60599 8.63249 10.483 11.7955 5.91739 numMergedOcc 0
21 mol 236 unq 1 iso 0 dist 5.6568 4.24722 7.74348 8.37813 8.52618 5.91739 numMergedOcc 0
22 mol 250 unq 0 iso 0 dist 9.54274 8.6355 8.69437 13.611 10.3257 8.51444 numMergedOcc 0
23 mol 250 unq 1 iso 0 dist 8.65735 7.30402 8.69437 14.559 10.3257 8.51444 numMergedOcc 0
24 mol 258 unq 0 iso 0 dist 9.46746 12.9568 8.57274 16.9377 12.3617 7.87648 numMergedOcc 0
25 mol 258 unq 1 iso 0 dist 7.31698 10.693 8.57274 17.2831 12.3617 7.87648 numMergedOcc 0
26 mol 273 unq 0 iso 0 dist 9.80002 5.87385 5.78262 13.6013 7.10817 9.16554 numMergedOcc 0
27 mol 273 unq 1 iso 0 dist 9.80002 5.87385 5.78262 10.6229 4.30863 8.83491 numMergedOcc 0
28 mol 273 unq 2 iso 0 dist 9.80002 10.5975 7.6489 10.6229 4.30863 9.02711 numMergedOcc 0
29 mol 273 unq 3 iso 0 dist 6.73794 3.92089 5.78262 6.38341 7.10817 9.16554 numMergedOcc 0
30 mol 273 unq 4 iso 0 dist 6.73794 3.92089 5.78262 9.78826 4.30863 8.83491 numMergedOcc 0
31 mol 273 unq 5 iso 0 dist 6.73794 12.0094 7.6489 9.78826 4.30863 9.02711 numMergedOcc 0
32 mol 277 unq 0 iso 0 dist 6.70414 12.5633 8.15119 16.1262 12.7485 9.35976 numMergedOcc 0
33 mol 293 unq 0 iso 0 dist 7.67909 5.86662 7.41524 9.83216 4.27008 6.67882 numMergedOcc 0
34 mol 293 unq 1 iso 0 dist 6.83404 5.86662 6.42608 9.83216 5.75555 6.67882 numMergedOcc 0
35 mol 293 unq 2 iso 0 dist 6.04186 6.74585 4.72125 10.3481 5.82185 6.67882 numMergedOcc 0
