0 mol 25 unq 0 iso 0 dist 7.05148 8.27137 11.0175 5.59268 7.92503 4.79873 numMergedOcc 0
1 mol 95 unq 0 iso 0 dist 9.49995 9.70292 5.88327 5.69671 9.49454 8.57395 numMergedOcc 0
2 mol 95 unq 1 iso 0 dist 9.49995 9.59704 3.96826 5.69671 9.49454 9.85409 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 5.94696 5.08983 3.92737 7.1452 4.47349 7.54889 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 5.94696 5.08983 3.92737 4.96747 5.65185 7.78931 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 5.37302 6.12348 3.84573 14.0364 9.66219 8.80934 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 8.47541 7.2672 3.84573 12.1308 9.66219 8.80934 numMergedOcc 0
7 mol 167 unq 0 iso 0 dist 9.14629 8.77904 8.91275 7.91498 9.67741 9.2289 numMergedOcc 0
8 mol 167 unq 1 iso 0 dist 9.14629 6.48993 5.95858 7.91498 9.67741 7.02548 numMergedOcc 0
9 mol 168 unq 0 iso 0 dist 8.90876 7.30338 4.02702 12.1014 7.44629 6.02086 numMergedOcc 0
10 mol 184 unq 0 iso 0 dist 8.95598 8.27396 4.67256 4.41193 6.42735 5.96423 numMergedOcc 0
11 mol 205 unq 0 iso 0 dist 7.23557 6.41148 9.86388 4.2475 4.8668 6.49765 numMergedOcc 0
12 mol 205 unq 1 iso 0 dist 8.86587 5.06713 9.86388 6.8901 4.8668 6.49765 numMergedOcc 0
13 mol 219 unq 0 iso 0 dist 7.13099 6.52136 5.75906 5.0241 7.59632 4.33238 numMergedOcc 0
14 mol 223 unq 0 iso 0 dist 7.81769 9.6936 3.86668 8.78003 7.48463 9.33543 numMergedOcc 0
15 mol 223 unq 1 iso 0 dist 7.66694 9.36733 3.86668 5.33327 7.48463 9.33543 numMergedOcc 0
16 mol 292 unq 0 iso 0 dist 6.60049 7.78796 3.92782 6.94727 9.88863 9.74118 numMergedOcc 0
