0 mol 33 unq 0 iso 0 dist 7.99091 8.43688 10.264 7.11991 7.82815 7.73662 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 8.66272 8.28883 13.2371 10.9194 6.68961 14.9723 numMergedOcc 0
2 mol 66 unq 0 iso 0 dist 9.03383 6.85819 5.49864 11.8384 7.3084 11.4916 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 9.85982 8.76389 4.83162 8.95801 9.90923 11.7333 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 4.52157 7.41952 5.65368 5.21981 7.7288 10.7273 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 7.45114 8.34427 12.7662 6.57177 8.90889 14.7747 numMergedOcc 0
6 mol 152 unq 0 iso 0 dist 6.26222 6.4737 7.54583 7.14838 6.75471 11.702 numMergedOcc 0
7 mol 157 unq 0 iso 0 dist 6.18988 9.668 7.14195 5.332 8.8201 9.35772 numMergedOcc 0
8 mol 186 unq 0 iso 0 dist 5.65146 7.02662 9.21526 13.4486 8.25953 13.507 numMergedOcc 0
9 mol 186 unq 1 iso 0 dist 7.87204 9.94142 8.42816 7.52497 6.49577 10.7466 numMergedOcc 0
10 mol 192 unq 0 iso 0 dist 8.40971 7.30965 9.583 12.5976 9.63224 17.0413 numMergedOcc 0
11 mol 192 unq 1 iso 0 dist 8.40971 7.30965 9.583 13.426 6.98794 15.2982 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 9.38418 7.00683 14.0964 8.11383 6.63935 14.4677 numMergedOcc 0
13 mol 215 unq 0 iso 0 dist 7.51339 9.44485 5.25766 9.14752 9.66981 13.4687 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 6.45234 9.17355 11.8854 7.86389 8.63649 16.3794 numMergedOcc 0
15 mol 223 unq 0 iso 0 dist 9.03969 9.29204 12.1037 8.1388 7.27963 15.6162 numMergedOcc 0
16 mol 223 unq 1 iso 0 dist 9.03969 9.14789 14.841 8.1388 7.27963 16.4821 numMergedOcc 0
17 mol 223 unq 2 iso 0 dist 9.03969 7.80764 11.4317 8.1388 7.27963 8.85178 numMergedOcc 0
18 mol 223 unq 3 iso 0 dist 9.03969 5.75896 4.44076 8.1388 7.27963 5.50267 numMergedOcc 0
19 mol 223 unq 4 iso 0 dist 9.03969 7.57564 6.5658 6.61072 7.5808 10.9498 numMergedOcc 0
20 mol 251 unq 0 iso 0 dist 8.50339 8.65339 5.99471 5.04918 6.67075 10.2087 numMergedOcc 0
21 mol 279 unq 0 iso 0 dist 7.06381 9.98985 9.69939 7.38256 5.61134 5.60922 numMergedOcc 0
22 mol 279 unq 1 iso 0 dist 7.06381 7.22295 12.0301 7.38256 5.61134 10.2864 numMergedOcc 0
23 mol 283 unq 0 iso 0 dist 8.76844 7.53773 8.99445 5.60193 5.7547 9.4181 numMergedOcc 0
