0 mol 26 unq 0 iso 0 dist 8.99751 6.77783 6.15893 6.67455 5.60332 8.63881 14.0176 8.95026 8.42581 12.7435 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.99751 6.77783 6.15893 14.0496 5.3241 9.33901 14.0176 8.95026 8.42581 7.46663 numMergedOcc 0
2 mol 26 unq 2 iso 0 dist 9.44507 6.77783 5.497 6.67455 7.30207 8.63881 14.0176 5.45023 8.42581 12.7435 numMergedOcc 0
3 mol 26 unq 3 iso 0 dist 9.44507 6.77783 5.497 14.0496 6.30968 9.33901 14.0176 5.45023 8.42581 7.46663 numMergedOcc 0
4 mol 26 unq 4 iso 0 dist 9.30674 5.24037 6.15893 9.2772 5.60332 8.63881 13.5897 8.95026 8.42581 12.7435 numMergedOcc 0
5 mol 26 unq 5 iso 0 dist 9.30674 5.24037 6.15893 13.6916 5.3241 9.33901 13.5897 8.95026 8.42581 7.46663 numMergedOcc 0
6 mol 26 unq 6 iso 0 dist 8.25567 4.82659 6.15893 10.9167 5.60332 8.63881 12.2521 8.95026 8.42581 12.7435 numMergedOcc 0
7 mol 26 unq 7 iso 0 dist 8.25567 4.82659 6.15893 11.184 5.3241 9.33901 12.2521 8.95026 8.42581 7.46663 numMergedOcc 0
8 mol 41 unq 0 iso 0 dist 5.31016 5.14132 6.73801 6.91278 4.65104 9.22814 8.19484 6.32189 5.52067 10.5378 numMergedOcc 0
9 mol 58 unq 0 iso 0 dist 5.84625 9.80755 9.11258 9.33642 4.92118 9.9648 14.311 13.9844 7.93481 12.1007 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 8.27794 8.32999 9.83981 8.79677 11.1547 6.06039 14.2539 11.4429 8.11094 8.20908 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 6.42904 5.80615 6.51868 12.4361 9.68947 7.46812 7.34386 4.35684 9.4062 13.7767 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 7.31633 6.2062 7.34698 5.84909 5.10826 7.46812 15.1711 11.668 9.4062 13.7767 numMergedOcc 0
13 mol 148 unq 0 iso 0 dist 9.80819 11.6995 9.73927 13.508 9.03832 9.21934 5.06687 7.89336 8.12589 8.68361 numMergedOcc 0
14 mol 150 unq 0 iso 0 dist 9.81665 11.8035 9.66129 13.5808 9.0892 9.13113 5.09809 7.86976 8.11592 8.73134 numMergedOcc 0
15 mol 173 unq 0 iso 0 dist 9.38737 10.5012 8.41245 11.5856 4.24035 9.71921 16.2888 9.77146 7.54706 11.0327 numMergedOcc 0
16 mol 173 unq 1 iso 0 dist 9.51638 12.905 6.64779 14.0649 5.66096 9.71921 17.5341 9.43677 7.54706 11.0327 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 9.07527 12.5567 8.9289 16.5452 9.06982 7.39743 9.91705 6.12563 7.96291 11.2585 numMergedOcc 0
18 mol 188 unq 0 iso 0 dist 9.37017 14.7966 9.33696 13.5626 5.01686 6.02957 11.8182 5.87427 7.48284 4.94877 numMergedOcc 0
19 mol 195 unq 0 iso 0 dist 8.13947 4.04021 9.82588 9.35664 7.07871 7.87044 12.5586 11.4252 9.79691 4.52076 numMergedOcc 0
