D0X1AF AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 4.696 -0.402 1.575 1.00 0.00 C HETATM 2 C UNL 1 4.056 -1.435 0.902 1.00 0.00 C HETATM 3 C UNL 1 3.760 -1.144 -0.420 1.00 0.00 C HETATM 4 C UNL 1 4.810 -0.611 -1.131 1.00 0.00 C HETATM 5 C UNL 1 5.495 0.419 -0.530 1.00 0.00 C HETATM 6 C UNL 1 5.208 0.646 0.813 1.00 0.00 C HETATM 7 O UNL 1 5.260 1.858 1.423 1.00 0.00 O HETATM 8 C UNL 1 5.114 2.977 0.531 1.00 0.00 C HETATM 9 C UNL 1 6.435 3.735 0.515 1.00 0.00 C HETATM 10 F UNL 1 7.480 2.925 0.706 1.00 0.00 F HETATM 11 F UNL 1 6.596 4.346 -0.678 1.00 0.00 F HETATM 12 F UNL 1 6.452 4.684 1.460 1.00 0.00 F HETATM 13 CL UNL 1 5.645 -1.589 -2.284 1.00 0.00 Cl HETATM 14 S UNL 1 2.209 -0.074 -0.429 1.00 0.00 S HETATM 15 C UNL 1 2.209 1.396 -1.365 1.00 0.00 C HETATM 16 C UNL 1 2.735 1.497 -2.790 1.00 0.00 C HETATM 17 C UNL 1 1.587 2.332 -3.392 1.00 0.00 C HETATM 18 N UNL 1 1.400 3.412 -2.355 1.00 0.00 N HETATM 19 C UNL 1 1.838 2.871 -1.016 1.00 0.00 C HETATM 20 C UNL 1 0.816 4.617 -2.790 1.00 0.00 C HETATM 21 C UNL 1 0.386 5.821 -1.919 1.00 0.00 C HETATM 22 O UNL 1 0.634 4.752 -4.003 1.00 0.00 O HETATM 23 C UNL 1 1.394 7.004 -1.762 1.00 0.00 C HETATM 24 C UNL 1 0.309 1.417 -3.440 1.00 0.00 C HETATM 25 N UNL 1 0.449 0.187 -4.086 1.00 0.00 N HETATM 26 C UNL 1 -0.708 -0.697 -4.050 1.00 0.00 C HETATM 27 C UNL 1 -1.809 0.121 -4.959 1.00 0.00 C HETATM 28 C UNL 1 -0.836 -1.840 -5.044 1.00 0.00 C HETATM 29 N UNL 1 -0.942 -2.788 -5.869 1.00 0.00 N HETATM 30 O UNL 1 1.271 -0.982 -1.079 1.00 0.00 O HETATM 31 O UNL 1 1.952 0.349 0.935 1.00 0.00 O HETATM 32 C UNL 1 -0.774 5.978 -0.918 1.00 0.00 C HETATM 33 C UNL 1 -1.091 6.161 -2.346 1.00 0.00 C HETATM 34 O UNL 1 -0.708 1.700 -2.801 1.00 0.00 O HETATM 35 C UNL 1 1.404 8.139 -2.602 1.00 0.00 C HETATM 36 C UNL 1 2.260 9.231 -2.365 1.00 0.00 C HETATM 37 C UNL 1 3.133 9.205 -1.283 1.00 0.00 C HETATM 38 C UNL 1 3.129 8.117 -0.417 1.00 0.00 C HETATM 39 C UNL 1 2.262 7.039 -0.653 1.00 0.00 C HETATM 40 BR UNL 1 4.315 10.647 -0.976 1.00 0.00 Br HETATM 41 C UNL 1 -1.733 1.454 -5.737 1.00 0.00 C HETATM 42 C UNL 1 -1.515 0.201 -6.494 1.00 0.00 C HETATM 43 H UNL 1 4.610 -0.333 2.655 1.00 0.00 H HETATM 44 H UNL 1 3.479 -2.174 1.454 1.00 0.00 H HETATM 45 H UNL 1 6.248 0.983 -1.066 1.00 0.00 H HETATM 46 H UNL 1 4.304 3.613 0.908 1.00 0.00 H HETATM 47 H UNL 1 4.833 2.714 -0.477 1.00 0.00 H HETATM 48 H UNL 1 1.153 1.153 -1.498 1.00 0.00 H HETATM 49 H UNL 1 2.908 0.547 -3.295 1.00 0.00 H HETATM 50 H UNL 1 3.668 2.083 -2.827 1.00 0.00 H HETATM 51 H UNL 1 1.796 2.739 -4.385 1.00 0.00 H HETATM 52 H UNL 1 1.018 2.969 -0.302 1.00 0.00 H HETATM 53 H UNL 1 2.679 3.484 -0.697 1.00 0.00 H HETATM 54 H UNL 1 1.045 0.148 -4.901 1.00 0.00 H HETATM 55 H UNL 1 -1.120 -0.869 -3.053 1.00 0.00 H HETATM 56 H UNL 1 -2.814 -0.152 -4.650 1.00 0.00 H HETATM 57 H UNL 1 -0.861 6.903 -0.341 1.00 0.00 H HETATM 58 H UNL 1 -1.172 5.124 -0.393 1.00 0.00 H HETATM 59 H UNL 1 -1.302 7.138 -2.764 1.00 0.00 H HETATM 60 H UNL 1 -1.706 5.380 -2.790 1.00 0.00 H HETATM 61 H UNL 1 0.711 8.205 -3.439 1.00 0.00 H HETATM 62 H UNL 1 2.227 10.097 -3.022 1.00 0.00 H HETATM 63 H UNL 1 3.779 8.104 0.455 1.00 0.00 H HETATM 64 H UNL 1 2.233 6.229 0.071 1.00 0.00 H HETATM 65 H UNL 1 -0.894 2.131 -5.670 1.00 0.00 H HETATM 66 H UNL 1 -2.657 1.965 -5.995 1.00 0.00 H HETATM 67 H UNL 1 -0.509 0.044 -6.881 1.00 0.00 H HETATM 68 H UNL 1 -2.274 -0.201 -7.157 1.00 0.00 H CONECT 1 2 6 43 CONECT 2 1 3 44 CONECT 3 2 4 14 CONECT 4 3 5 13 CONECT 5 4 6 45 CONECT 6 5 1 7 CONECT 7 6 8 CONECT 8 7 9 46 47 CONECT 9 8 10 11 12 CONECT 10 9 CONECT 11 9 CONECT 12 9 CONECT 13 4 CONECT 14 3 15 30 31 CONECT 15 14 16 19 48 CONECT 16 15 17 49 50 CONECT 17 16 18 24 51 CONECT 18 17 19 20 CONECT 19 18 15 52 53 CONECT 20 18 21 22 CONECT 21 20 23 32 33 CONECT 22 20 CONECT 23 21 35 39 CONECT 24 17 25 34 CONECT 25 24 26 54 CONECT 26 25 27 28 55 CONECT 27 26 41 42 56 CONECT 28 26 29 CONECT 29 28 CONECT 30 14 CONECT 31 14 CONECT 32 21 33 57 58 CONECT 33 32 21 59 60 CONECT 34 24 CONECT 35 23 36 61 CONECT 36 35 37 62 CONECT 37 36 38 40 CONECT 38 37 39 63 CONECT 39 38 23 64 CONECT 40 37 CONECT 41 27 42 65 66 CONECT 42 41 27 67 68 CONECT 43 1 CONECT 44 2 CONECT 45 5 CONECT 46 8 CONECT 47 8 CONECT 48 15 CONECT 49 16 CONECT 50 16 CONECT 51 17 CONECT 52 19 CONECT 53 19 CONECT 54 25 CONECT 55 26 CONECT 56 27 CONECT 57 32 CONECT 58 32 CONECT 59 33 CONECT 60 33 CONECT 61 35 CONECT 62 36 CONECT 63 38 CONECT 64 39 CONECT 65 41 CONECT 66 41 CONECT 67 42 CONECT 68 42 MASTER 0 0 0 0 0 0 0 0 68 0 68 0 END M END $$$$