0 mol 9 unq 0 iso 0 dist 5.99711 4.46001 7.25684 5.99669 7.88249 5.26687 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 5.99711 11.6572 8.22285 5.99669 7.88249 15.0721 numMergedOcc 0
2 mol 13 unq 0 iso 0 dist 5.04036 11.1067 8.00865 9.97413 8.81649 5.47592 numMergedOcc 0
3 mol 13 unq 1 iso 0 dist 5.04036 13.4623 9.11447 9.97413 8.81649 14.0992 numMergedOcc 0
4 mol 13 unq 2 iso 0 dist 9.44958 11.4587 8.00865 15.3827 8.81649 5.47592 numMergedOcc 0
5 mol 13 unq 3 iso 0 dist 9.44958 4.14738 9.11447 15.3827 8.81649 14.0992 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 9.69215 11.6013 9.36424 6.73754 5.98267 6.45249 numMergedOcc 0
7 mol 52 unq 0 iso 0 dist 9.46302 8.88127 8.65019 6.99094 7.59119 10.4146 numMergedOcc 0
8 mol 74 unq 0 iso 0 dist 9.43699 10.1834 4.79413 10.8087 7.66662 8.68626 numMergedOcc 0
9 mol 74 unq 1 iso 0 dist 5.23115 3.94075 4.79413 11.4327 7.66662 8.68626 numMergedOcc 0
10 mol 94 unq 0 iso 0 dist 7.13726 4.4432 9.13207 5.37951 7.14138 5.34241 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 9.19335 10.2495 7.59814 6.07245 7.03758 4.7742 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 8.5076 4.49984 8.07135 6.07245 9.31778 9.5551 numMergedOcc 0
13 mol 133 unq 2 iso 0 dist 8.5076 10.2495 9.7775 6.07245 9.31778 4.7742 numMergedOcc 0
14 mol 133 unq 3 iso 0 dist 7.34386 5.80615 9.4062 4.48767 6.08509 6.14787 numMergedOcc 0
15 mol 140 unq 0 iso 0 dist 7.85653 6.63467 8.01587 5.35142 5.30663 4.96936 numMergedOcc 0
16 mol 175 unq 0 iso 0 dist 9.12296 10.3187 7.01126 6.35499 9.58615 10.9284 numMergedOcc 0
17 mol 181 unq 0 iso 0 dist 9.91705 6.24616 5.49808 3.96762 9.2826 5.3049 numMergedOcc 0
18 mol 181 unq 1 iso 0 dist 9.91705 12.5567 7.96291 3.96762 9.2826 10.8044 numMergedOcc 0
19 mol 181 unq 2 iso 0 dist 7.92476 5.56759 5.49808 10.501 9.2826 5.3049 numMergedOcc 0
20 mol 181 unq 3 iso 0 dist 7.92476 4.43465 7.96291 10.501 9.2826 10.8044 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 8.28454 8.59036 7.29542 6.86366 5.40513 9.68884 numMergedOcc 0
22 mol 252 unq 0 iso 0 dist 5.22349 7.31906 6.57207 4.59117 7.19006 10.4784 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 9.49787 9.33248 9.51311 14.4428 9.15911 16.1291 numMergedOcc 0
24 mol 264 unq 0 iso 0 dist 8.28871 9.63193 9.42738 5.63694 6.74637 4.59547 numMergedOcc 0
25 mol 264 unq 1 iso 0 dist 7.94668 12.2052 9.42738 11.6787 6.74637 4.59547 numMergedOcc 0
26 mol 270 unq 0 iso 0 dist 8.05859 12.734 6.31869 4.18076 9.88151 12.917 numMergedOcc 0
27 mol 272 unq 0 iso 0 dist 8.62966 6.83359 6.45328 13.6524 9.84461 7.3779 numMergedOcc 0
