0 mol 62 unq 0 iso 0 dist 4.85282 4.93315 5.02909 6.02731 7.46975 8.90117 numMergedOcc 0
1 mol 67 unq 0 iso 0 dist 5.77675 7.72671 5.66613 5.86118 4.31746 4.53519 numMergedOcc 0
2 mol 98 unq 0 iso 0 dist 4.3761 7.40481 6.38409 9.66226 11.2155 16.4222 numMergedOcc 0
3 mol 98 unq 1 iso 0 dist 5.84583 7.40481 12.4885 9.66226 9.51607 16.4222 numMergedOcc 0
4 mol 100 unq 0 iso 0 dist 8.08937 9.25746 6.24215 8.11279 4.86724 9.64716 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 8.8763 7.4713 10.1927 6.37224 4.1431 6.06934 numMergedOcc 0
6 mol 103 unq 1 iso 0 dist 8.8763 8.91952 12.8681 6.37224 4.1431 11.4548 numMergedOcc 0
7 mol 171 unq 0 iso 0 dist 7.7195 7.38306 14.8177 8.53734 4.98945 14.1926 numMergedOcc 0
8 mol 171 unq 1 iso 0 dist 9.43988 7.38306 4.63854 8.53734 13.7258 14.1926 numMergedOcc 0
9 mol 225 unq 0 iso 0 dist 9.60654 8.621 13.456 8.65088 7.43844 11.0434 numMergedOcc 0
10 mol 225 unq 1 iso 0 dist 7.11262 8.621 10.6299 8.65088 4.32093 11.0434 numMergedOcc 0
11 mol 233 unq 0 iso 0 dist 8.73545 5.9677 8.98176 5.83278 11.4985 5.93475 numMergedOcc 0
12 mol 233 unq 1 iso 0 dist 8.14581 5.9677 9.65009 5.83278 5.74726 5.93475 numMergedOcc 0
13 mol 243 unq 0 iso 0 dist 6.5095 6.77411 5.58254 7.24253 10.2558 13.3958 numMergedOcc 0
14 mol 243 unq 1 iso 0 dist 6.5095 6.77411 5.58254 7.83742 7.31632 3.89742 numMergedOcc 0
15 mol 243 unq 2 iso 0 dist 5.1766 6.77411 10.2776 7.24253 3.87679 13.3958 numMergedOcc 0
16 mol 243 unq 3 iso 0 dist 5.1766 6.77411 10.2776 7.83742 10.9686 3.89742 numMergedOcc 0
17 mol 260 unq 0 iso 0 dist 8.79012 5.72892 12.3866 7.23618 7.55193 11.1091 numMergedOcc 0
18 mol 272 unq 0 iso 0 dist 6.20857 8.38819 4.35986 9.88921 14.5298 14.3851 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 6.84909 8.23483 12.3921 5.54272 6.08322 6.60931 numMergedOcc 0
