0 mol 11 unq 0 iso 0 dist 9.52695 6.65725 8.73067 12.8782 12.8869 6.35021 9.46202 10.0282 3.56133 5.40468 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 9.78754 6.35394 9.09091 12.8696 12.6523 6.56599 9.26728 9.81983 3.66215 5.47299 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.99751 10.7581 7.22361 6.67455 5.60332 7.24149 3.30063 9.82851 12.6238 6.70325 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 8.99751 6.77783 6.15893 6.67455 5.60332 8.63881 3.30063 9.82851 7.97596 6.70325 numMergedOcc 0
4 mol 26 unq 2 iso 0 dist 9.44507 6.77783 5.497 6.67455 7.30207 8.63881 3.30063 9.11311 7.97596 6.70325 numMergedOcc 0
5 mol 26 unq 3 iso 0 dist 9.30674 11.3546 7.22361 9.2772 5.60332 7.24149 6.79894 9.82851 12.6238 6.70325 numMergedOcc 0
6 mol 26 unq 4 iso 0 dist 9.30674 5.24037 6.15893 9.2772 5.60332 8.63881 6.79894 9.82851 7.97596 6.70325 numMergedOcc 0
7 mol 26 unq 5 iso 0 dist 8.25567 10.6733 7.22361 10.9167 5.60332 7.24149 10.8557 9.82851 12.6238 6.70325 numMergedOcc 0
8 mol 26 unq 6 iso 0 dist 8.25567 4.82659 6.15893 10.9167 5.60332 8.63881 10.8557 9.82851 7.97596 6.70325 numMergedOcc 0
9 mol 41 unq 0 iso 0 dist 5.31016 5.14132 6.73801 6.91278 4.65104 9.22814 3.84207 8.95105 7.42205 9.14632 numMergedOcc 0
10 mol 58 unq 0 iso 0 dist 5.84625 9.80755 9.11258 9.33642 4.92118 9.9648 6.09663 6.41008 4.43437 9.33736 numMergedOcc 0
11 mol 114 unq 0 iso 0 dist 8.27794 8.32999 9.83981 8.79677 11.1547 6.06039 6.83136 12.9866 6.52215 5.87382 numMergedOcc 0
12 mol 114 unq 1 iso 0 dist 8.27794 5.28095 6.13559 8.79677 11.1547 9.36502 6.83136 12.9866 8.68818 5.87382 numMergedOcc 0
13 mol 148 unq 0 iso 0 dist 9.80819 11.6995 9.73927 13.508 9.03832 9.21934 15.1552 10.0716 4.43652 9.0735 numMergedOcc 0
14 mol 150 unq 0 iso 0 dist 9.81665 11.8035 9.66129 13.5808 9.0892 9.13113 15.2935 10.0288 4.48089 9.03593 numMergedOcc 0
15 mol 157 unq 0 iso 0 dist 9.30128 9.06676 6.455 8.78412 6.22449 8.18826 6.11737 13.2232 12.7342 9.46735 numMergedOcc 0
16 mol 181 unq 0 iso 0 dist 9.07527 12.5567 8.9289 16.5452 9.06982 7.39743 14.6405 12.1137 4.22401 8.76671 numMergedOcc 0
17 mol 188 unq 0 iso 0 dist 9.37017 14.7966 9.33696 13.5626 5.01686 6.02957 11.2153 8.4784 4.61059 7.50005 numMergedOcc 0
