0 mol 62 unq 0 iso 0 dist 9.65672 8.67162 5.38781 13.5485 9.79863 14.5306 numMergedOcc 0
1 mol 62 unq 1 iso 0 dist 9.65672 8.79114 9.2836 13.5485 9.79863 17.8153 numMergedOcc 0
2 mol 103 unq 0 iso 0 dist 5.52999 5.78029 6.58346 9.46459 9.68619 14.1683 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 7.40577 7.48533 6.72133 3.88006 4.86767 8.42878 numMergedOcc 0
4 mol 141 unq 0 iso 0 dist 9.28415 7.6793 10.9933 12.541 8.46376 16.4417 numMergedOcc 0
5 mol 147 unq 0 iso 0 dist 9.21476 9.41073 13.0818 7.38323 9.77522 15.7997 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 6.20851 6.21194 6.4423 4.47323 6.4751 5.25109 numMergedOcc 0
7 mol 171 unq 1 iso 0 dist 6.20851 6.21194 6.4423 4.73373 5.75085 8.21618 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 6.7407 9.38737 4.67407 5.68427 8.79135 13.0362 numMergedOcc 0
9 mol 204 unq 0 iso 0 dist 8.40718 8.62191 10.8845 15.9432 9.23676 18.1181 numMergedOcc 0
10 mol 223 unq 0 iso 0 dist 7.29418 7.81769 5.25583 4.29891 7.24878 9.81271 numMergedOcc 0
11 mol 223 unq 1 iso 0 dist 8.63099 7.66694 5.25583 5.70788 7.24878 9.81271 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 5.6568 8.37813 8.52618 5.99041 8.88405 10.3951 numMergedOcc 0
13 mol 236 unq 1 iso 0 dist 5.6568 8.37813 8.52618 5.55311 7.13854 13.0171 numMergedOcc 0
14 mol 236 unq 2 iso 0 dist 5.6568 9.25988 7.35248 5.99041 8.88405 14.5767 numMergedOcc 0
15 mol 236 unq 3 iso 0 dist 5.6568 9.25988 7.35248 5.55311 7.13854 10.6733 numMergedOcc 0
16 mol 247 unq 0 iso 0 dist 8.40674 6.18065 5.44215 10.7268 6.29945 8.45756 numMergedOcc 0
17 mol 273 unq 0 iso 0 dist 6.73794 6.38341 7.10817 14.6347 9.57659 15.201 numMergedOcc 0
18 mol 273 unq 1 iso 0 dist 6.73794 6.38341 7.10817 10.6008 7.8424 13.2096 numMergedOcc 0
19 mol 273 unq 2 iso 0 dist 6.73794 9.78826 4.30863 14.6347 9.57659 11.5121 numMergedOcc 0
20 mol 273 unq 3 iso 0 dist 6.73794 9.78826 4.30863 10.6008 7.8424 11.0304 numMergedOcc 0
