0 mol 68 unq 0 iso 0 dist 7.94809 6.27321 13.6446 5.16912 11.4987 7.07989 numMergedOcc 0
1 mol 68 unq 1 iso 0 dist 7.94809 6.27321 13.6446 14.5387 22.2316 9.77272 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 9.41961 5.40928 5.69897 3.99657 13.0089 8.60535 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 9.29166 5.76805 5.69897 6.11801 13.0089 8.60535 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 6.35752 8.64736 3.69039 6.61758 7.70787 7.57443 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.88238 8.64736 15.0328 6.61758 9.57191 7.57443 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 7.69672 6.15011 12.4367 5.27016 12.2787 5.62309 numMergedOcc 0
7 mol 169 unq 0 iso 0 dist 6.58855 9.71763 12.3204 14.3008 14.8153 5.51388 numMergedOcc 0
8 mol 169 unq 1 iso 0 dist 6.58855 9.71763 12.3204 16.5605 19.5085 8.17917 numMergedOcc 0
9 mol 169 unq 2 iso 0 dist 6.58855 9.71763 12.3204 12.1929 14.6442 8.68909 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 8.12102 8.76228 9.00139 9.91529 13.8854 9.51638 numMergedOcc 0
11 mol 173 unq 1 iso 0 dist 7.95138 8.76228 7.55884 9.91529 8.32347 9.51638 numMergedOcc 0
12 mol 180 unq 0 iso 0 dist 8.90665 8.92145 5.83084 4.10999 11.1749 8.79411 numMergedOcc 0
13 mol 225 unq 0 iso 0 dist 7.70125 7.51337 7.66364 13.8982 17.3406 9.79381 numMergedOcc 0
14 mol 225 unq 1 iso 0 dist 7.70125 7.51337 7.66364 14.2286 15.9772 8.37379 numMergedOcc 0
15 mol 270 unq 0 iso 0 dist 8.19788 6.97639 11.4433 8.5694 13.4008 8.50042 numMergedOcc 0
16 mol 273 unq 0 iso 0 dist 8.20612 6.59092 9.23974 13.9951 17.8994 9.78826 numMergedOcc 0
