0 mol 24 unq 0 iso 0 dist 8.15652 8.23069 4.93188 7.40392 4.33963 5.54419 10.9024 8.70141 13.2653 9.54519 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 8.15652 8.59466 9.24958 7.40392 4.33963 7.36323 10.9024 8.70141 5.80023 9.54519 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 6.44893 9.67461 4.93188 10.6551 4.33963 5.54419 10.7171 8.70141 13.2653 9.54519 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 6.44893 14.0586 9.24958 10.6551 4.33963 7.36323 10.7171 8.70141 5.80023 9.54519 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 8.8533 10.1933 5.69955 12.8678 10.6756 8.34347 14.5971 17.8374 15.0931 9.7522 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 6.87744 10.4881 5.69955 15.294 10.6756 8.34347 23.9198 17.8374 15.0931 9.7522 numMergedOcc 0
6 mol 26 unq 2 iso 0 dist 7.2612 5.2549 8.44506 11.9393 13.2876 8.34347 8.25643 13.1078 5.3315 6.88695 numMergedOcc 0
7 mol 43 unq 0 iso 0 dist 9.17687 14.4151 9.93832 14.9853 9.06158 8.80331 21.9301 16.6874 11.0096 8.38387 numMergedOcc 0
8 mol 43 unq 1 iso 0 dist 9.17687 10.3283 8.60739 14.9853 9.06158 6.20293 21.9301 16.6874 11.8286 8.38387 numMergedOcc 0
9 mol 71 unq 0 iso 0 dist 9.62428 5.27838 7.77916 11.4175 6.6504 7.38797 5.07949 7.23173 4.93292 7.35142 numMergedOcc 0
10 mol 71 unq 1 iso 0 dist 9.62428 5.27838 7.77916 11.4175 6.6504 7.38797 10.9768 13.0117 6.53623 9.50139 numMergedOcc 0
11 mol 112 unq 0 iso 0 dist 5.9819 6.84034 9.92283 12.6327 17.3924 9.60462 6.92638 10.7968 6.68714 7.15985 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 8.37793 13.2145 6.76699 9.00172 5.74088 6.29155 13.3005 10.8945 10.2385 5.82404 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 9.88251 14.4147 8.44861 13.4053 5.28092 6.03031 16.8495 10.6084 4.6995 5.96555 numMergedOcc 0
14 mol 205 unq 1 iso 0 dist 9.88251 13.9684 5.60393 13.4053 5.28092 7.26832 16.8495 10.6084 10.7091 5.96555 numMergedOcc 0
15 mol 236 unq 0 iso 0 dist 9.33359 12.8358 8.50331 17.4517 9.05842 7.68742 22.7698 16.2625 11.247 9.89665 numMergedOcc 0
16 mol 236 unq 1 iso 0 dist 9.33359 12.8358 8.50331 8.95071 7.00028 6.27581 9.48296 8.38439 4.15973 5.66569 numMergedOcc 0
17 mol 236 unq 2 iso 0 dist 9.33359 12.8358 8.50331 8.95071 7.00028 6.27581 5.05085 9.30828 9.01197 6.11137 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 5.5826 5.18833 7.32982 10.5161 12.3808 5.72887 14.3608 16.6013 12.521 9.94315 numMergedOcc 0
19 mol 238 unq 1 iso 0 dist 5.5826 5.18833 7.32982 10.5161 12.3808 5.72887 10.0091 13.3717 9.18011 8.59074 numMergedOcc 0
20 mol 238 unq 2 iso 0 dist 5.5826 5.18833 7.32982 10.5161 12.3808 5.72887 6.4298 10.8216 4.7157 6.2365 numMergedOcc 0
21 mol 272 unq 0 iso 0 dist 9.00781 9.92738 9.05222 12.454 6.59863 8.48753 15.0607 12.6659 5.26991 9.64596 numMergedOcc 0
