0 mol 64 unq 0 iso 0 dist 7.8986 8.52643 7.05519 15.4665 12.2258 8.75668 10.9916 14.1776 8.6701 10.9873 numMergedOcc 0
1 mol 64 unq 1 iso 0 dist 7.8986 8.52643 7.05519 9.48441 6.6003 9.64871 10.9916 14.1776 8.6701 13.1454 numMergedOcc 0
2 mol 64 unq 2 iso 0 dist 7.8986 8.52643 7.05519 4.76091 6.44118 9.95118 10.9916 14.1776 8.6701 13.1314 numMergedOcc 0
3 mol 64 unq 3 iso 0 dist 7.24183 5.41357 7.05519 9.95527 12.2258 8.75668 7.48046 14.1776 8.6701 10.9873 numMergedOcc 0
4 mol 64 unq 4 iso 0 dist 7.24183 5.41357 7.05519 6.41829 6.6003 9.64871 7.48046 14.1776 8.6701 13.1454 numMergedOcc 0
5 mol 64 unq 5 iso 0 dist 7.24183 5.41357 7.05519 6.13923 6.44118 9.95118 7.48046 14.1776 8.6701 13.1314 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 9.27331 7.45777 4.68175 12.3394 9.02288 6.3777 7.85784 10.1296 5.88827 6.28792 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 9.27331 7.45777 4.68175 12.3394 9.02288 6.3777 14.3054 11.0617 9.66175 4.4893 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 8.98151 5.83719 8.21735 4.87509 12.982 6.5087 3.75302 12.5105 8.95465 4.62865 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 7.07348 9.96635 10.9312 16.6371 17.4721 9.99005 13.4119 14.1102 7.76952 3.45021 numMergedOcc 0
10 mol 158 unq 1 iso 0 dist 7.07348 9.96635 10.9312 16.6371 17.4721 9.99005 12.6695 15.9309 9.98554 18.84 numMergedOcc 0
11 mol 204 unq 0 iso 0 dist 7.00683 9.52029 8.61406 18.5654 15.2431 9.44947 16.0878 16.6657 8.98633 12.2033 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 7.58998 6.23677 6.88745 6.87755 6.23882 7.49783 10.602 14.3695 7.80646 14.4014 numMergedOcc 0
13 mol 239 unq 0 iso 0 dist 9.59937 7.58554 5.94643 8.27566 12.985 7.78671 10.9079 11.1939 5.4687 6.79067 numMergedOcc 0
14 mol 244 unq 0 iso 0 dist 6.51428 7.79787 13.4155 10.5547 16.5923 9.21656 4.80974 8.75742 9.45199 8.49798 numMergedOcc 0
15 mol 244 unq 1 iso 0 dist 6.51428 7.79787 13.4155 10.5547 16.5923 9.21656 13.59 18.3375 9.07512 9.54706 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 9.50814 7.52632 3.89234 6.35501 9.72927 6.45326 10.5232 9.47603 6.04835 5.46481 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 6.23539 6.66936 5.95045 7.44724 6.90434 4.81916 14.4215 13.4083 9.07744 7.75371 numMergedOcc 0
