D0I5DE AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -1.733 -0.895 1.844 1.00 0.00 C HETATM 2 C UNL 1 -3.853 -0.959 2.473 1.00 0.00 C HETATM 3 C UNL 1 -5.146 -1.718 1.909 1.00 0.00 C HETATM 4 C UNL 1 -5.264 -0.873 0.978 1.00 0.00 C HETATM 5 C UNL 1 -1.085 -0.873 0.978 1.00 0.00 C HETATM 6 C UNL 1 0.355 -0.873 0.978 1.00 0.00 C HETATM 7 N UNL 1 -3.860 -1.602 0.158 1.00 0.00 N HETATM 8 C UNL 1 -3.083 -2.753 1.245 1.00 0.00 C HETATM 9 N UNL 1 -1.690 -2.619 0.998 1.00 0.00 N HETATM 10 N UNL 1 -3.814 -3.370 2.625 1.00 0.00 N HETATM 11 C UNL 1 -3.426 -4.332 3.602 1.00 0.00 C HETATM 12 C UNL 1 -4.190 -5.342 4.240 1.00 0.00 C HETATM 13 C UNL 1 -3.411 -6.482 4.302 1.00 0.00 C HETATM 14 C UNL 1 -2.016 -6.492 4.501 1.00 0.00 C HETATM 15 C UNL 1 -1.301 -5.382 4.134 1.00 0.00 C HETATM 16 C UNL 1 -2.047 -4.298 3.770 1.00 0.00 C HETATM 17 CL UNL 1 -5.880 -5.858 4.163 1.00 0.00 Cl HETATM 18 CL UNL 1 -0.833 -1.174 3.666 1.00 0.00 Cl HETATM 19 N UNL 1 -6.039 -1.153 2.798 1.00 0.00 N HETATM 20 C UNL 1 0.189 -5.322 4.073 1.00 0.00 C HETATM 21 N UNL 1 0.723 -4.927 5.354 1.00 0.00 N HETATM 22 C UNL 1 2.082 -5.014 5.548 1.00 0.00 C HETATM 23 O UNL 1 2.870 -5.318 4.662 1.00 0.00 O HETATM 24 C UNL 1 2.620 -4.777 6.934 1.00 0.00 C HETATM 25 C UNL 1 -3.261 -0.336 -0.417 1.00 0.00 C HETATM 26 C UNL 1 -8.053 -1.079 2.164 1.00 0.00 C HETATM 27 C UNL 1 -10.183 -1.703 2.486 1.00 0.00 C HETATM 28 N UNL 1 -11.052 -2.893 3.592 1.00 0.00 N HETATM 29 C UNL 1 -9.292 -3.270 4.047 1.00 0.00 C HETATM 30 C UNL 1 -7.450 -2.583 3.334 1.00 0.00 C HETATM 31 C UNL 1 -12.735 -3.410 4.103 1.00 0.00 C HETATM 32 C UNL 1 3.203 -6.388 7.336 1.00 0.00 C HETATM 33 C UNL 1 3.995 -5.211 7.458 1.00 0.00 C HETATM 34 C UNL 1 -14.506 -3.234 3.850 1.00 0.00 C HETATM 35 C UNL 1 -15.822 -4.078 4.729 1.00 0.00 C HETATM 36 C UNL 1 -15.597 -5.052 5.825 1.00 0.00 C HETATM 37 C UNL 1 -14.152 -5.222 6.098 1.00 0.00 C HETATM 38 C UNL 1 -12.905 -4.487 5.233 1.00 0.00 C HETATM 39 C UNL 1 2.827 -3.218 7.051 1.00 0.00 C HETATM 40 F UNL 1 2.596 -2.593 5.860 1.00 0.00 F HETATM 41 F UNL 1 1.996 -2.633 7.950 1.00 0.00 F HETATM 42 F UNL 1 4.094 -2.845 7.400 1.00 0.00 F HETATM 43 C UNL 1 -16.608 -5.878 6.736 1.00 0.00 C HETATM 44 F UNL 1 -17.958 -5.726 6.555 1.00 0.00 F HETATM 45 F UNL 1 -16.406 -7.235 6.648 1.00 0.00 F HETATM 46 F UNL 1 -16.414 -5.608 8.069 1.00 0.00 F HETATM 47 H UNL 1 -5.525 -2.762 1.855 1.00 0.00 H HETATM 48 H UNL 1 1.008 -1.414 1.663 1.00 0.00 H HETATM 49 H UNL 1 -4.193 -2.663 3.343 1.00 0.00 H HETATM 50 H UNL 1 -3.509 -6.670 3.187 1.00 0.00 H HETATM 51 H UNL 1 -1.506 -7.413 4.742 1.00 0.00 H HETATM 52 H UNL 1 -1.527 -3.439 3.414 1.00 0.00 H HETATM 53 H UNL 1 0.584 -4.656 3.286 1.00 0.00 H HETATM 54 H UNL 1 0.570 -6.318 3.830 1.00 0.00 H HETATM 55 H UNL 1 0.078 -4.561 6.045 1.00 0.00 H HETATM 56 H UNL 1 -4.078 0.221 -0.890 1.00 0.00 H HETATM 57 H UNL 1 -2.463 -0.579 -1.107 1.00 0.00 H HETATM 58 H UNL 1 -2.954 0.418 0.344 1.00 0.00 H HETATM 59 H UNL 1 -8.393 -1.523 1.043 1.00 0.00 H HETATM 60 H UNL 1 -8.634 -0.066 2.200 1.00 0.00 H HETATM 61 H UNL 1 -10.788 -2.196 1.603 1.00 0.00 H HETATM 62 H UNL 1 -10.974 -0.937 2.742 1.00 0.00 H HETATM 63 H UNL 1 -9.383 -4.354 3.820 1.00 0.00 H HETATM 64 H UNL 1 -9.407 -3.080 5.117 1.00 0.00 H HETATM 65 H UNL 1 -8.113 -1.733 3.810 1.00 0.00 H HETATM 66 H UNL 1 -7.973 -2.986 2.269 1.00 0.00 H HETATM 67 H UNL 1 3.571 -7.058 6.542 1.00 0.00 H HETATM 68 H UNL 1 3.114 -6.970 8.252 1.00 0.00 H HETATM 69 H UNL 1 4.804 -5.052 6.757 1.00 0.00 H HETATM 70 H UNL 1 4.239 -4.924 8.480 1.00 0.00 H HETATM 71 H UNL 1 -15.141 -2.674 3.107 1.00 0.00 H HETATM 72 H UNL 1 -16.951 -3.960 4.536 1.00 0.00 H HETATM 73 H UNL 1 -13.901 -5.950 6.866 1.00 0.00 H HETATM 74 H UNL 1 -13.854 -4.657 4.706 1.00 0.00 H CONECT 1 2 6 18 CONECT 2 1 3 19 CONECT 3 2 4 47 CONECT 4 3 5 7 CONECT 5 4 6 9 CONECT 6 5 1 48 CONECT 7 4 8 25 CONECT 8 7 9 10 CONECT 9 8 5 CONECT 10 8 11 49 CONECT 11 10 12 16 CONECT 12 11 13 17 CONECT 13 12 14 50 CONECT 14 13 15 51 CONECT 15 14 16 20 CONECT 16 15 11 52 CONECT 17 12 CONECT 18 1 CONECT 19 2 26 30 CONECT 20 15 21 53 54 CONECT 21 20 22 55 CONECT 22 21 23 24 CONECT 23 22 CONECT 24 22 32 33 39 CONECT 25 7 56 57 58 CONECT 26 19 27 59 60 CONECT 27 26 28 61 62 CONECT 28 27 29 31 CONECT 29 28 30 63 64 CONECT 30 29 19 65 66 CONECT 31 28 34 38 CONECT 32 24 33 67 68 CONECT 33 32 24 69 70 CONECT 34 31 35 71 CONECT 35 34 36 72 CONECT 36 35 37 43 CONECT 37 36 38 73 CONECT 38 37 31 74 CONECT 39 24 40 41 42 CONECT 40 39 CONECT 41 39 CONECT 42 39 CONECT 43 36 44 45 46 CONECT 44 43 CONECT 45 43 CONECT 46 43 CONECT 47 3 CONECT 48 6 CONECT 49 10 CONECT 50 13 CONECT 51 14 CONECT 52 16 CONECT 53 20 CONECT 54 20 CONECT 55 21 CONECT 56 25 CONECT 57 25 CONECT 58 25 CONECT 59 26 CONECT 60 26 CONECT 61 27 CONECT 62 27 CONECT 63 29 CONECT 64 29 CONECT 65 30 CONECT 66 30 CONECT 67 32 CONECT 68 32 CONECT 69 33 CONECT 70 33 CONECT 71 34 CONECT 72 35 CONECT 73 37 CONECT 74 38 MASTER 0 0 0 0 0 0 0 0 74 0 74 0 END M END $$$$