D0U9OH AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.930 0.022 -0.149 1.00 0.00 C HETATM 2 C UNL 1 0.200 0.783 0.785 1.00 0.00 C HETATM 3 C UNL 1 0.825 1.681 1.676 1.00 0.00 C HETATM 4 C UNL 1 2.190 1.930 1.545 1.00 0.00 C HETATM 5 C UNL 1 2.922 1.096 0.626 1.00 0.00 C HETATM 6 C UNL 1 2.322 0.102 -0.194 1.00 0.00 C HETATM 7 BR UNL 1 -1.687 0.519 0.836 1.00 0.00 Br HETATM 8 C UNL 1 3.197 -0.851 -1.032 1.00 0.00 C HETATM 9 N UNL 1 2.565 -1.856 -1.762 1.00 0.00 N HETATM 10 O UNL 1 4.416 -0.721 -1.021 1.00 0.00 O HETATM 11 C UNL 1 3.166 -2.814 -2.730 1.00 0.00 C HETATM 12 C UNL 1 2.287 -3.074 -3.972 1.00 0.00 C HETATM 13 C UNL 1 1.135 -2.117 -4.155 1.00 0.00 C HETATM 14 N UNL 1 0.601 -1.973 -5.392 1.00 0.00 N HETATM 15 C UNL 1 0.788 -2.863 -6.412 1.00 0.00 C HETATM 16 C UNL 1 1.602 -3.906 -6.186 1.00 0.00 C HETATM 17 C UNL 1 2.360 -4.052 -4.928 1.00 0.00 C HETATM 18 C UNL 1 3.200 -5.308 -4.898 1.00 0.00 C HETATM 19 C UNL 1 0.029 -2.586 -7.659 1.00 0.00 C HETATM 20 O UNL 1 0.606 -1.521 -3.219 1.00 0.00 O HETATM 21 O UNL 1 0.155 1.983 2.830 1.00 0.00 O HETATM 22 C UNL 1 -0.133 3.339 3.113 1.00 0.00 C HETATM 23 C UNL 1 1.035 4.167 3.514 1.00 0.00 C HETATM 24 C UNL 1 2.339 4.013 3.232 1.00 0.00 C HETATM 25 C UNL 1 2.986 2.945 2.362 1.00 0.00 C HETATM 26 C UNL 1 3.296 5.040 3.824 1.00 0.00 C HETATM 27 H UNL 1 0.381 -0.659 -0.789 1.00 0.00 H HETATM 28 H UNL 1 4.008 1.200 0.590 1.00 0.00 H HETATM 29 H UNL 1 1.555 -1.813 -1.820 1.00 0.00 H HETATM 30 H UNL 1 4.131 -2.409 -3.054 1.00 0.00 H HETATM 31 H UNL 1 3.346 -3.744 -2.181 1.00 0.00 H HETATM 32 H UNL 1 -0.116 -1.268 -5.456 1.00 0.00 H HETATM 33 H UNL 1 1.736 -4.645 -6.976 1.00 0.00 H HETATM 34 H UNL 1 2.991 -5.972 -5.757 1.00 0.00 H HETATM 35 H UNL 1 2.967 -5.912 -4.015 1.00 0.00 H HETATM 36 H UNL 1 4.272 -5.100 -4.936 1.00 0.00 H HETATM 37 H UNL 1 -0.349 -1.554 -7.669 1.00 0.00 H HETATM 38 H UNL 1 -0.837 -3.250 -7.726 1.00 0.00 H HETATM 39 H UNL 1 0.654 -2.705 -8.547 1.00 0.00 H HETATM 40 H UNL 1 -0.712 3.823 2.320 1.00 0.00 H HETATM 41 H UNL 1 -0.788 3.305 3.994 1.00 0.00 H HETATM 42 H UNL 1 0.745 5.010 4.143 1.00 0.00 H HETATM 43 H UNL 1 3.687 2.383 2.990 1.00 0.00 H HETATM 44 H UNL 1 3.582 3.501 1.623 1.00 0.00 H HETATM 45 H UNL 1 2.780 5.768 4.468 1.00 0.00 H HETATM 46 H UNL 1 3.792 5.607 3.037 1.00 0.00 H HETATM 47 H UNL 1 4.050 4.551 4.450 1.00 0.00 H CONECT 1 2 6 27 CONECT 2 1 3 7 CONECT 3 2 4 21 CONECT 4 3 5 25 CONECT 5 4 6 28 CONECT 6 5 1 8 CONECT 7 2 CONECT 8 6 9 10 CONECT 9 8 11 29 CONECT 10 8 CONECT 11 9 12 30 31 CONECT 12 11 13 17 CONECT 13 12 14 20 CONECT 14 13 15 32 CONECT 15 14 16 19 CONECT 16 15 17 33 CONECT 17 16 12 18 CONECT 18 17 34 35 36 CONECT 19 15 37 38 39 CONECT 20 13 CONECT 21 3 22 CONECT 22 21 23 40 41 CONECT 23 22 24 42 CONECT 24 23 25 26 CONECT 25 24 4 43 44 CONECT 26 24 45 46 47 CONECT 27 1 CONECT 28 5 CONECT 29 9 CONECT 30 11 CONECT 31 11 CONECT 32 14 CONECT 33 16 CONECT 34 18 CONECT 35 18 CONECT 36 18 CONECT 37 19 CONECT 38 19 CONECT 39 19 CONECT 40 22 CONECT 41 22 CONECT 42 23 CONECT 43 25 CONECT 44 25 CONECT 45 26 CONECT 46 26 CONECT 47 26 MASTER 0 0 0 0 0 0 0 0 47 0 47 0 END M END $$$$