0 mol 8 unq 0 iso 0 dist 9.00925 8.68949 16.2669 6.04779 14.4873 7.74386 10.8849 19.557 9.42634 8.53141 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 7.38928 5.35252 5.03338 10.6637 14.2843 9.79657 8.12843 12.6567 8.52681 10.6247 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 7.38928 5.35252 5.03338 10.6637 14.2843 9.79657 9.72202 14.8248 9.98769 7.07594 numMergedOcc 0
3 mol 64 unq 0 iso 0 dist 7.8986 8.52643 7.05519 7.59945 10.9115 5.45684 10.9916 14.1776 8.6701 4.80256 numMergedOcc 0
4 mol 64 unq 1 iso 0 dist 7.8986 8.52643 7.05519 13.3239 14.6782 7.76644 10.9916 14.1776 8.6701 5.13486 numMergedOcc 0
5 mol 64 unq 2 iso 0 dist 7.24183 5.41357 7.05519 5.65551 10.9115 5.45684 7.48046 14.1776 8.6701 4.80256 numMergedOcc 0
6 mol 64 unq 3 iso 0 dist 7.24183 5.41357 7.05519 9.81422 14.6782 7.76644 7.48046 14.1776 8.6701 5.13486 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 9.27331 7.45777 4.68175 10.345 10.4593 6.85356 7.85784 10.1296 5.88827 8.50831 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 9.27331 7.45777 4.68175 10.345 10.4593 6.85356 14.3054 11.0617 9.66175 14.8359 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 9.27331 7.45777 4.68175 14.1204 7.21285 7.32265 7.85784 10.1296 5.88827 10.3098 numMergedOcc 0
10 mol 73 unq 3 iso 0 dist 9.27331 7.45777 4.68175 14.1204 7.21285 7.32265 14.3054 11.0617 9.66175 6.35914 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 7.02854 5.73235 5.22567 10.2556 13.6767 9.26231 5.50078 10.0184 9.50939 14.6307 numMergedOcc 0
12 mol 90 unq 0 iso 0 dist 6.6146 9.06641 5.12529 6.3566 8.6308 7.94379 4.77556 5.28331 7.01987 4.28396 numMergedOcc 0
13 mol 158 unq 0 iso 0 dist 7.07348 9.96635 10.9312 17.5374 17.9783 8.95432 13.4119 14.1102 7.76952 5.70473 numMergedOcc 0
14 mol 158 unq 1 iso 0 dist 7.07348 9.96635 10.9312 17.5374 17.9783 8.95432 12.6695 15.9309 9.98554 17.2865 numMergedOcc 0
15 mol 165 unq 0 iso 0 dist 8.2197 7.21397 10.5947 6.27901 14.2061 7.8052 6.22764 4.63353 8.00005 11.4281 numMergedOcc 0
16 mol 183 unq 0 iso 0 dist 7.69421 8.97652 9.01399 4.92164 9.82833 9.84649 14.3669 17.4248 8.69656 14.1568 numMergedOcc 0
17 mol 186 unq 0 iso 0 dist 7.02662 6.72718 6.12748 11.315 13.7617 9.60838 8.09407 12.9744 8.92335 5.21542 numMergedOcc 0
18 mol 192 unq 0 iso 0 dist 7.30965 6.2016 5.21255 6.16078 7.72242 5.83093 9.82858 13.0939 7.97601 9.42206 numMergedOcc 0
19 mol 204 unq 0 iso 0 dist 7.00683 9.52029 8.61406 13.8486 16.5867 9.23669 16.0878 16.6657 8.98633 5.41527 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 7.58998 6.23677 6.88745 8.8161 14.6984 8.96263 10.602 14.3695 7.80646 6.81831 numMergedOcc 0
21 mol 224 unq 1 iso 0 dist 8.71944 8.82663 5.45067 11.6942 12.0757 7.35677 4.93894 8.32306 5.95109 6.81831 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 6.00654 8.86185 8.20191 10.1043 8.78008 7.80073 6.16212 9.94177 9.58325 7.79949 numMergedOcc 0
23 mol 239 unq 1 iso 0 dist 9.59937 7.58554 5.94643 8.46058 8.01565 7.10828 10.9079 11.1939 5.4687 10.0889 numMergedOcc 0
24 mol 244 unq 0 iso 0 dist 6.51428 7.79787 13.4155 8.64762 13.0526 6.2667 4.80974 8.75742 9.45199 7.17774 numMergedOcc 0
25 mol 244 unq 1 iso 0 dist 6.51428 7.79787 13.4155 8.64762 13.0526 6.2667 13.59 18.3375 9.07512 5.2958 numMergedOcc 0
26 mol 249 unq 0 iso 0 dist 7.58833 3.67935 4.88298 6.13333 6.04688 5.70674 8.32339 7.80866 9.04147 5.63037 numMergedOcc 0
27 mol 249 unq 1 iso 0 dist 9.04715 3.67935 5.75331 6.13333 9.50034 5.70674 8.32339 13.9394 9.04147 5.63037 numMergedOcc 0
28 mol 261 unq 0 iso 0 dist 9.70222 4.85199 10.6318 5.03102 11.7325 9.38192 4.30068 12.8603 7.14871 3.67073 numMergedOcc 0
29 mol 261 unq 1 iso 0 dist 9.70222 4.85199 10.6318 6.40309 13.5235 6.99444 4.30068 12.8603 7.14871 9.24385 numMergedOcc 0
30 mol 261 unq 2 iso 0 dist 9.71882 9.13604 10.6318 9.37836 11.7325 9.38192 10.2597 12.8603 7.14871 3.67073 numMergedOcc 0
31 mol 261 unq 3 iso 0 dist 9.71882 9.13604 10.6318 5.91745 13.5235 6.99444 10.2597 12.8603 7.14871 9.24385 numMergedOcc 0
32 mol 282 unq 0 iso 0 dist 8.61456 5.00258 9.80233 6.38947 12.7565 6.51248 4.4471 11.9006 7.21879 9.17043 numMergedOcc 0
33 mol 282 unq 1 iso 0 dist 8.41041 8.22117 9.80233 5.98603 12.7565 6.51248 10.1631 11.9006 7.21879 9.17043 numMergedOcc 0
