D0A8KL AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 4.215 0.457 2.258 1.00 0.00 C HETATM 2 C UNL 1 5.052 -0.549 2.813 1.00 0.00 C HETATM 3 C UNL 1 5.391 -1.687 2.042 1.00 0.00 C HETATM 4 C UNL 1 4.725 -1.835 0.826 1.00 0.00 C HETATM 5 C UNL 1 3.449 -1.298 0.892 1.00 0.00 C HETATM 6 C UNL 1 3.523 0.064 1.107 1.00 0.00 C HETATM 7 S UNL 1 5.829 -0.692 4.337 1.00 0.00 S HETATM 8 C UNL 1 6.498 -2.200 3.845 1.00 0.00 C HETATM 9 N UNL 1 6.307 -2.552 2.593 1.00 0.00 N HETATM 10 N UNL 1 3.351 0.923 -0.007 1.00 0.00 N HETATM 11 N UNL 1 2.580 -1.929 1.972 1.00 0.00 N HETATM 12 C UNL 1 2.382 -3.319 2.226 1.00 0.00 C HETATM 13 C UNL 1 2.660 -4.222 1.216 1.00 0.00 C HETATM 14 C UNL 1 1.659 -5.095 0.843 1.00 0.00 C HETATM 15 C UNL 1 0.510 -5.188 1.628 1.00 0.00 C HETATM 16 C UNL 1 0.464 -4.586 2.887 1.00 0.00 C HETATM 17 C UNL 1 1.454 -3.676 3.215 1.00 0.00 C HETATM 18 CL UNL 1 1.405 -2.865 4.737 1.00 0.00 Cl HETATM 19 BR UNL 1 -1.038 -5.980 0.904 1.00 0.00 Br HETATM 20 S UNL 1 2.066 2.007 0.024 1.00 0.00 S HETATM 21 F UNL 1 5.053 -2.728 -0.111 1.00 0.00 F HETATM 22 O UNL 1 1.746 2.255 1.404 1.00 0.00 O HETATM 23 O UNL 1 2.434 3.096 -0.859 1.00 0.00 O HETATM 24 C UNL 1 0.585 1.241 -0.763 1.00 0.00 C HETATM 25 C UNL 1 0.717 1.147 -2.279 1.00 0.00 C HETATM 26 C UNL 1 0.780 -0.096 -1.450 1.00 0.00 C HETATM 27 C UNL 1 -0.693 1.358 0.015 1.00 0.00 C HETATM 28 C UNL 1 -1.094 2.699 0.627 1.00 0.00 C HETATM 29 C UNL 1 -1.577 3.751 -0.371 1.00 0.00 C HETATM 30 O UNL 1 -2.165 2.453 1.564 1.00 0.00 O HETATM 31 O UNL 1 -1.951 4.933 0.347 1.00 0.00 O HETATM 32 H UNL 1 4.126 1.442 2.695 1.00 0.00 H HETATM 33 H UNL 1 7.051 -2.828 4.530 1.00 0.00 H HETATM 34 H UNL 1 4.190 1.423 -0.294 1.00 0.00 H HETATM 35 H UNL 1 1.656 -1.492 1.880 1.00 0.00 H HETATM 36 H UNL 1 3.541 -4.138 0.591 1.00 0.00 H HETATM 37 H UNL 1 1.744 -5.602 -0.115 1.00 0.00 H HETATM 38 H UNL 1 -0.384 -4.731 3.547 1.00 0.00 H HETATM 39 H UNL 1 1.647 1.425 -2.772 1.00 0.00 H HETATM 40 H UNL 1 -0.153 1.314 -2.903 1.00 0.00 H HETATM 41 H UNL 1 1.717 -0.628 -1.365 1.00 0.00 H HETATM 42 H UNL 1 -0.071 -0.772 -1.530 1.00 0.00 H HETATM 43 H UNL 1 -0.630 0.626 0.830 1.00 0.00 H HETATM 44 H UNL 1 -1.530 1.001 -0.606 1.00 0.00 H HETATM 45 H UNL 1 -0.310 3.148 1.233 1.00 0.00 H HETATM 46 H UNL 1 -2.467 3.405 -0.907 1.00 0.00 H HETATM 47 H UNL 1 -0.796 4.015 -1.090 1.00 0.00 H HETATM 48 H UNL 1 -2.925 2.094 1.072 1.00 0.00 H HETATM 49 H UNL 1 -2.055 4.681 1.288 1.00 0.00 H CONECT 1 2 6 32 CONECT 2 1 3 7 CONECT 3 2 4 9 CONECT 4 3 5 21 CONECT 5 4 6 11 CONECT 6 5 1 10 CONECT 7 2 8 CONECT 8 7 9 33 CONECT 9 8 3 CONECT 10 6 20 34 CONECT 11 5 12 35 CONECT 12 11 13 17 CONECT 13 12 14 36 CONECT 14 13 15 37 CONECT 15 14 16 19 CONECT 16 15 17 38 CONECT 17 16 12 18 CONECT 18 17 CONECT 19 15 CONECT 20 10 22 23 24 CONECT 21 4 CONECT 22 20 CONECT 23 20 CONECT 24 20 25 26 27 CONECT 25 24 26 39 40 CONECT 26 25 24 41 42 CONECT 27 24 28 43 44 CONECT 28 27 29 30 45 CONECT 29 28 31 46 47 CONECT 30 28 48 CONECT 31 29 49 CONECT 32 1 CONECT 33 8 CONECT 34 10 CONECT 35 11 CONECT 36 13 CONECT 37 14 CONECT 38 16 CONECT 39 25 CONECT 40 25 CONECT 41 26 CONECT 42 26 CONECT 43 27 CONECT 44 27 CONECT 45 28 CONECT 46 29 CONECT 47 29 CONECT 48 30 CONECT 49 31 MASTER 0 0 0 0 0 0 0 0 49 0 49 0 END M END $$$$