D09IGN AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.871 1.063 2.532 1.00 0.00 C HETATM 2 C UNL 1 4.167 1.108 1.701 1.00 0.00 C HETATM 3 C UNL 1 4.013 2.403 0.912 1.00 0.00 C HETATM 4 C UNL 1 2.415 2.547 0.831 1.00 0.00 C HETATM 5 N UNL 1 1.892 1.183 1.443 1.00 0.00 N HETATM 6 C UNL 1 1.900 3.715 1.875 1.00 0.00 C HETATM 7 C UNL 1 5.358 0.638 2.469 1.00 0.00 C HETATM 8 C UNL 1 0.533 3.995 2.194 1.00 0.00 C HETATM 9 C UNL 1 0.132 4.664 3.447 1.00 0.00 C HETATM 10 C UNL 1 1.123 4.823 4.427 1.00 0.00 C HETATM 11 C UNL 1 2.446 4.610 4.089 1.00 0.00 C HETATM 12 C UNL 1 2.818 4.257 2.792 1.00 0.00 C HETATM 13 C UNL 1 -1.145 5.196 3.844 1.00 0.00 C HETATM 14 C UNL 1 -1.381 5.808 5.120 1.00 0.00 C HETATM 15 C UNL 1 -0.381 5.821 6.082 1.00 0.00 C HETATM 16 C UNL 1 0.852 5.289 5.728 1.00 0.00 C HETATM 17 C UNL 1 6.114 -0.441 1.959 1.00 0.00 C HETATM 18 C UNL 1 7.127 -1.025 2.716 1.00 0.00 C HETATM 19 C UNL 1 7.401 -0.555 3.993 1.00 0.00 C HETATM 20 C UNL 1 6.633 0.484 4.514 1.00 0.00 C HETATM 21 C UNL 1 5.614 1.077 3.767 1.00 0.00 C HETATM 22 CL UNL 1 8.014 -2.354 2.079 1.00 0.00 Cl HETATM 23 CL UNL 1 6.919 1.032 6.119 1.00 0.00 Cl HETATM 24 O UNL 1 -0.409 6.293 7.362 1.00 0.00 O HETATM 25 C UNL 1 -1.412 7.205 7.781 1.00 0.00 C HETATM 26 S UNL 1 1.734 -0.480 0.870 1.00 0.00 S HETATM 27 C UNL 1 0.122 -0.790 1.633 1.00 0.00 C HETATM 28 C UNL 1 -0.945 -0.992 0.786 1.00 0.00 C HETATM 29 C UNL 1 -2.218 -1.135 1.322 1.00 0.00 C HETATM 30 C UNL 1 -2.416 -1.086 2.711 1.00 0.00 C HETATM 31 C UNL 1 -1.314 -0.894 3.560 1.00 0.00 C HETATM 32 C UNL 1 -0.034 -0.752 3.029 1.00 0.00 C HETATM 33 C UNL 1 -3.760 -1.296 3.319 1.00 0.00 C HETATM 34 O UNL 1 -3.859 -1.723 4.463 1.00 0.00 O HETATM 35 N UNL 1 -4.865 -1.010 2.537 1.00 0.00 N HETATM 36 C UNL 1 -6.207 -1.345 3.001 1.00 0.00 C HETATM 37 C UNL 1 -6.711 -0.387 4.058 1.00 0.00 C HETATM 38 O UNL 1 1.602 -0.570 -0.548 1.00 0.00 O HETATM 39 O UNL 1 2.645 -1.375 1.590 1.00 0.00 O HETATM 40 C UNL 1 -8.019 -0.882 4.606 1.00 0.00 C HETATM 41 O UNL 1 -9.109 -0.602 4.132 1.00 0.00 O HETATM 42 O UNL 1 -7.868 -1.704 5.667 1.00 0.00 O HETATM 43 H UNL 1 2.668 1.874 3.223 1.00 0.00 H HETATM 44 H UNL 1 2.746 0.189 3.165 1.00 0.00 H HETATM 45 H UNL 1 4.123 0.395 0.866 1.00 0.00 H HETATM 46 H UNL 1 4.476 2.321 -0.082 1.00 0.00 H HETATM 47 H UNL 1 4.572 3.217 1.371 1.00 0.00 H HETATM 48 H UNL 1 2.092 2.792 -0.191 1.00 0.00 H HETATM 49 H UNL 1 -0.249 3.682 1.501 1.00 0.00 H HETATM 50 H UNL 1 3.227 4.768 4.828 1.00 0.00 H HETATM 51 H UNL 1 3.881 4.324 2.613 1.00 0.00 H HETATM 52 H UNL 1 -1.965 5.194 3.128 1.00 0.00 H HETATM 53 H UNL 1 -2.351 6.252 5.327 1.00 0.00 H HETATM 54 H UNL 1 1.642 5.305 6.478 1.00 0.00 H HETATM 55 H UNL 1 5.873 -0.875 0.987 1.00 0.00 H HETATM 56 H UNL 1 8.189 -1.010 4.584 1.00 0.00 H HETATM 57 H UNL 1 4.984 1.838 4.222 1.00 0.00 H HETATM 58 H UNL 1 -1.260 7.382 8.855 1.00 0.00 H HETATM 59 H UNL 1 -2.416 6.796 7.658 1.00 0.00 H HETATM 60 H UNL 1 -1.304 8.173 7.282 1.00 0.00 H HETATM 61 H UNL 1 -0.802 -1.026 -0.289 1.00 0.00 H HETATM 62 H UNL 1 -3.035 -1.307 0.632 1.00 0.00 H HETATM 63 H UNL 1 -1.464 -0.838 4.640 1.00 0.00 H HETATM 64 H UNL 1 0.803 -0.598 3.708 1.00 0.00 H HETATM 65 H UNL 1 -4.762 -0.556 1.640 1.00 0.00 H HETATM 66 H UNL 1 -6.162 -2.373 3.401 1.00 0.00 H HETATM 67 H UNL 1 -6.852 -1.362 2.128 1.00 0.00 H HETATM 68 H UNL 1 -6.880 0.605 3.628 1.00 0.00 H HETATM 69 H UNL 1 -6.004 -0.230 4.886 1.00 0.00 H HETATM 70 H UNL 1 -6.927 -1.864 5.886 1.00 0.00 H CONECT 1 2 5 43 44 CONECT 2 1 3 7 45 CONECT 3 2 4 46 47 CONECT 4 3 5 6 48 CONECT 5 4 1 26 CONECT 6 8 12 4 CONECT 7 17 21 2 CONECT 8 6 9 49 CONECT 9 8 10 13 CONECT 10 9 11 16 CONECT 11 10 12 50 CONECT 12 11 6 51 CONECT 13 9 14 52 CONECT 14 13 15 53 CONECT 15 14 16 24 CONECT 16 15 10 54 CONECT 17 7 18 55 CONECT 18 17 19 22 CONECT 19 18 20 56 CONECT 20 19 21 23 CONECT 21 20 7 57 CONECT 22 18 CONECT 23 20 CONECT 24 15 25 CONECT 25 24 58 59 60 CONECT 26 5 27 38 39 CONECT 27 26 28 32 CONECT 28 27 29 61 CONECT 29 28 30 62 CONECT 30 29 31 33 CONECT 31 30 32 63 CONECT 32 31 27 64 CONECT 33 30 34 35 CONECT 34 33 CONECT 35 33 36 65 CONECT 36 35 37 66 67 CONECT 37 36 40 68 69 CONECT 38 26 CONECT 39 26 CONECT 40 37 41 42 CONECT 41 40 CONECT 42 40 70 CONECT 43 1 CONECT 44 1 CONECT 45 2 CONECT 46 3 CONECT 47 3 CONECT 48 4 CONECT 49 8 CONECT 50 11 CONECT 51 12 CONECT 52 13 CONECT 53 14 CONECT 54 16 CONECT 55 17 CONECT 56 19 CONECT 57 21 CONECT 58 25 CONECT 59 25 CONECT 60 25 CONECT 61 28 CONECT 62 29 CONECT 63 31 CONECT 64 32 CONECT 65 35 CONECT 66 36 CONECT 67 36 CONECT 68 37 CONECT 69 37 CONECT 70 42 MASTER 0 0 0 0 0 0 0 0 70 0 70 0 END M END $$$$