D0OK1S AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 3.202 0.337 0.877 1.00 0.00 C HETATM 2 C UNL 1 4.093 -0.725 0.880 1.00 0.00 C HETATM 3 C UNL 1 4.359 -1.449 2.086 1.00 0.00 C HETATM 4 C UNL 1 4.042 -1.017 3.383 1.00 0.00 C HETATM 5 C UNL 1 3.063 0.036 3.276 1.00 0.00 C HETATM 6 C UNL 1 2.606 0.633 2.073 1.00 0.00 C HETATM 7 C UNL 1 4.755 -0.820 4.827 1.00 0.00 C HETATM 8 C UNL 1 10.333 -2.191 5.258 1.00 0.00 C HETATM 9 C UNL 1 8.939 -1.848 5.150 1.00 0.00 C HETATM 10 C UNL 1 8.099 -0.586 4.534 1.00 0.00 C HETATM 11 C UNL 1 6.635 0.356 4.424 1.00 0.00 C HETATM 12 C UNL 1 5.042 0.411 5.107 1.00 0.00 C HETATM 13 C UNL 1 5.644 -0.104 6.704 1.00 0.00 C HETATM 14 C UNL 1 6.620 0.457 2.763 1.00 0.00 C HETATM 15 O UNL 1 7.707 0.469 1.775 1.00 0.00 O HETATM 16 C UNL 1 7.707 1.730 0.955 1.00 0.00 C HETATM 17 C UNL 1 8.227 1.448 -0.333 1.00 0.00 C HETATM 18 C UNL 1 9.571 1.473 -0.497 1.00 0.00 C HETATM 19 C UNL 1 10.360 2.204 0.378 1.00 0.00 C HETATM 20 C UNL 1 9.714 3.009 1.335 1.00 0.00 C HETATM 21 C UNL 1 8.353 2.799 1.590 1.00 0.00 C HETATM 22 C UNL 1 11.848 2.271 0.102 1.00 0.00 C HETATM 23 N UNL 1 12.694 1.725 1.196 1.00 0.00 N HETATM 24 C UNL 1 12.259 0.311 1.314 1.00 0.00 C HETATM 25 C UNL 1 12.759 -0.529 2.462 1.00 0.00 C HETATM 26 C UNL 1 13.311 0.245 3.624 1.00 0.00 C HETATM 27 C UNL 1 13.604 1.704 3.452 1.00 0.00 C HETATM 28 C UNL 1 12.595 2.409 2.546 1.00 0.00 C HETATM 29 BR UNL 1 7.349 4.386 1.991 1.00 0.00 Br HETATM 30 C UNL 1 12.943 3.909 2.632 1.00 0.00 C HETATM 31 O UNL 1 12.473 4.693 3.449 1.00 0.00 O HETATM 32 O UNL 1 13.979 4.332 1.854 1.00 0.00 O HETATM 33 H UNL 1 3.002 0.909 -0.026 1.00 0.00 H HETATM 34 H UNL 1 4.573 -1.002 -0.054 1.00 0.00 H HETATM 35 H UNL 1 4.874 -2.358 1.872 1.00 0.00 H HETATM 36 H UNL 1 2.722 0.533 4.189 1.00 0.00 H HETATM 37 H UNL 1 1.796 1.364 2.100 1.00 0.00 H HETATM 38 H UNL 1 11.333 -2.437 5.336 1.00 0.00 H HETATM 39 H UNL 1 8.305 -2.379 5.880 1.00 0.00 H HETATM 40 H UNL 1 8.804 -0.205 3.740 1.00 0.00 H HETATM 41 H UNL 1 6.688 -0.462 6.614 1.00 0.00 H HETATM 42 H UNL 1 5.095 -1.004 7.041 1.00 0.00 H HETATM 43 H UNL 1 5.604 0.697 7.423 1.00 0.00 H HETATM 44 H UNL 1 5.889 1.174 2.453 1.00 0.00 H HETATM 45 H UNL 1 6.333 -0.601 2.706 1.00 0.00 H HETATM 46 H UNL 1 7.581 1.132 -1.144 1.00 0.00 H HETATM 47 H UNL 1 9.999 0.972 -1.358 1.00 0.00 H HETATM 48 H UNL 1 10.239 3.855 1.772 1.00 0.00 H HETATM 49 H UNL 1 12.044 3.339 -0.065 1.00 0.00 H HETATM 50 H UNL 1 12.051 1.809 -0.863 1.00 0.00 H HETATM 51 H UNL 1 12.507 -0.233 0.396 1.00 0.00 H HETATM 52 H UNL 1 11.161 0.285 1.405 1.00 0.00 H HETATM 53 H UNL 1 13.490 -1.272 2.124 1.00 0.00 H HETATM 54 H UNL 1 11.916 -1.129 2.839 1.00 0.00 H HETATM 55 H UNL 1 12.565 0.194 4.424 1.00 0.00 H HETATM 56 H UNL 1 14.247 -0.223 3.936 1.00 0.00 H HETATM 57 H UNL 1 14.638 1.888 3.120 1.00 0.00 H HETATM 58 H UNL 1 13.583 2.088 4.475 1.00 0.00 H HETATM 59 H UNL 1 11.573 2.342 2.924 1.00 0.00 H HETATM 60 H UNL 1 14.524 3.675 1.336 1.00 0.00 H CONECT 1 2 6 33 CONECT 2 1 3 34 CONECT 3 2 4 35 CONECT 4 3 5 7 CONECT 5 4 6 36 CONECT 6 5 1 37 CONECT 7 4 8 12 CONECT 8 7 9 38 CONECT 9 8 10 39 CONECT 10 9 11 40 CONECT 11 10 12 14 CONECT 12 11 7 13 CONECT 13 12 41 42 43 CONECT 14 11 15 44 45 CONECT 15 14 16 CONECT 16 15 17 21 CONECT 17 16 18 46 CONECT 18 17 19 47 CONECT 19 18 20 22 CONECT 20 19 21 48 CONECT 21 20 16 29 CONECT 22 19 23 49 50 CONECT 23 22 24 28 CONECT 24 23 25 51 52 CONECT 25 24 26 53 54 CONECT 26 25 27 55 56 CONECT 27 26 28 57 58 CONECT 28 27 23 30 59 CONECT 29 21 CONECT 30 28 31 32 CONECT 31 30 CONECT 32 30 60 CONECT 33 1 CONECT 34 2 CONECT 35 3 CONECT 36 5 CONECT 37 6 CONECT 38 8 CONECT 39 9 CONECT 40 10 CONECT 41 13 CONECT 42 13 CONECT 43 13 CONECT 44 14 CONECT 45 14 CONECT 46 17 CONECT 47 18 CONECT 48 20 CONECT 49 22 CONECT 50 22 CONECT 51 24 CONECT 52 24 CONECT 53 25 CONECT 54 25 CONECT 55 26 CONECT 56 26 CONECT 57 27 CONECT 58 27 CONECT 59 28 CONECT 60 32 MASTER 0 0 0 0 0 0 0 0 60 0 60 0 END M END $$$$