D0ZN3M AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -7.369 6.749 -0.304 1.00 0.00 C HETATM 2 O UNL 1 -6.676 5.497 -0.418 1.00 0.00 O HETATM 3 C UNL 1 -6.333 5.144 -1.693 1.00 0.00 C HETATM 4 N UNL 1 -6.383 3.797 -1.848 1.00 0.00 N HETATM 5 C UNL 1 -5.406 3.048 -2.718 1.00 0.00 C HETATM 6 C UNL 1 -4.281 2.788 -1.613 1.00 0.00 C HETATM 7 N UNL 1 -3.030 2.312 -1.895 1.00 0.00 N HETATM 8 C UNL 1 -1.981 1.861 -0.934 1.00 0.00 C HETATM 9 C UNL 1 -2.534 1.532 0.458 1.00 0.00 C HETATM 10 C UNL 1 -2.530 2.322 1.533 1.00 0.00 C HETATM 11 S UNL 1 -2.957 1.693 3.121 1.00 0.00 S HETATM 12 C UNL 1 -6.632 8.003 0.121 1.00 0.00 C HETATM 13 C UNL 1 -5.325 8.346 -0.260 1.00 0.00 C HETATM 14 C UNL 1 -4.806 9.611 0.056 1.00 0.00 C HETATM 15 C UNL 1 -5.541 10.514 0.824 1.00 0.00 C HETATM 16 C UNL 1 -6.799 10.150 1.284 1.00 0.00 C HETATM 17 C UNL 1 -7.363 8.946 0.869 1.00 0.00 C HETATM 18 O UNL 1 -6.039 5.967 -2.550 1.00 0.00 O HETATM 19 O UNL 1 -4.640 2.869 -0.423 1.00 0.00 O HETATM 20 C UNL 1 -5.311 3.737 -4.113 1.00 0.00 C HETATM 21 C UNL 1 -4.684 3.120 -5.345 1.00 0.00 C HETATM 22 C UNL 1 -5.299 3.213 -6.611 1.00 0.00 C HETATM 23 C UNL 1 -4.566 2.983 -7.791 1.00 0.00 C HETATM 24 C UNL 1 -3.298 2.439 -7.717 1.00 0.00 C HETATM 25 C UNL 1 -2.823 2.099 -6.465 1.00 0.00 C HETATM 26 C UNL 1 -3.376 2.676 -5.328 1.00 0.00 C HETATM 27 C UNL 1 -0.738 2.789 -0.906 1.00 0.00 C HETATM 28 C UNL 1 0.474 2.273 -0.066 1.00 0.00 C HETATM 29 C UNL 1 1.065 0.962 -0.593 1.00 0.00 C HETATM 30 C UNL 1 1.582 3.332 -0.012 1.00 0.00 C HETATM 31 O UNL 1 -4.155 2.718 3.553 1.00 0.00 O HETATM 32 C UNL 1 -4.879 2.556 4.707 1.00 0.00 C HETATM 33 C UNL 1 -4.590 1.601 5.708 1.00 0.00 C HETATM 34 C UNL 1 -5.409 1.499 6.839 1.00 0.00 C HETATM 35 C UNL 1 -6.501 2.348 6.990 1.00 0.00 C HETATM 36 C UNL 1 -6.773 3.317 6.014 1.00 0.00 C HETATM 37 C UNL 1 -5.951 3.416 4.893 1.00 0.00 C HETATM 38 BR UNL 1 -7.629 2.171 8.495 1.00 0.00 Br HETATM 39 O UNL 1 -3.514 0.376 2.956 1.00 0.00 O HETATM 40 O UNL 1 -1.839 1.921 4.006 1.00 0.00 O HETATM 41 H UNL 1 -8.111 6.548 0.478 1.00 0.00 H HETATM 42 H UNL 1 -7.944 6.957 -1.214 1.00 0.00 H HETATM 43 H UNL 1 -6.516 3.354 -0.943 1.00 0.00 H HETATM 44 H UNL 1 -5.869 2.064 -2.870 1.00 0.00 H HETATM 45 H UNL 1 -2.776 2.196 -2.859 1.00 0.00 H HETATM 46 H UNL 1 -1.649 0.916 -1.355 1.00 0.00 H HETATM 47 H UNL 1 -2.905 0.523 0.539 1.00 0.00 H HETATM 48 H UNL 1 -2.157 3.330 1.522 1.00 0.00 H HETATM 49 H UNL 1 -4.706 7.649 -0.812 1.00 0.00 H HETATM 50 H UNL 1 -3.814 9.900 -0.296 1.00 0.00 H HETATM 51 H UNL 1 -5.139 11.494 1.067 1.00 0.00 H HETATM 52 H UNL 1 -7.349 10.800 1.957 1.00 0.00 H HETATM 53 H UNL 1 -8.399 8.741 1.130 1.00 0.00 H HETATM 54 H UNL 1 -4.838 4.717 -4.030 1.00 0.00 H HETATM 55 H UNL 1 -6.361 3.922 -4.401 1.00 0.00 H HETATM 56 H UNL 1 -6.325 3.557 -6.713 1.00 0.00 H HETATM 57 H UNL 1 -5.002 3.184 -8.766 1.00 0.00 H HETATM 58 H UNL 1 -2.722 2.209 -8.608 1.00 0.00 H HETATM 59 H UNL 1 -2.259 1.171 -6.370 1.00 0.00 H HETATM 60 H UNL 1 -2.714 2.967 -4.524 1.00 0.00 H HETATM 61 H UNL 1 -1.029 3.781 -0.532 1.00 0.00 H HETATM 62 H UNL 1 -0.400 2.950 -1.937 1.00 0.00 H HETATM 63 H UNL 1 0.161 2.098 0.970 1.00 0.00 H HETATM 64 H UNL 1 1.333 1.042 -1.651 1.00 0.00 H HETATM 65 H UNL 1 0.365 0.130 -0.473 1.00 0.00 H HETATM 66 H UNL 1 1.975 0.696 -0.040 1.00 0.00 H HETATM 67 H UNL 1 1.978 3.547 -1.009 1.00 0.00 H HETATM 68 H UNL 1 2.416 2.991 0.614 1.00 0.00 H HETATM 69 H UNL 1 1.209 4.265 0.422 1.00 0.00 H HETATM 70 H UNL 1 -3.743 0.921 5.635 1.00 0.00 H HETATM 71 H UNL 1 -5.184 0.747 7.592 1.00 0.00 H HETATM 72 H UNL 1 -7.617 3.991 6.142 1.00 0.00 H HETATM 73 H UNL 1 -6.181 4.168 4.127 1.00 0.00 H CONECT 1 2 12 41 42 CONECT 2 1 3 CONECT 3 2 4 18 CONECT 4 3 5 43 CONECT 5 20 6 4 44 CONECT 6 7 19 5 CONECT 7 6 8 45 CONECT 8 27 9 7 46 CONECT 9 10 8 47 CONECT 10 9 11 48 CONECT 11 10 31 39 40 CONECT 12 1 13 17 CONECT 13 12 14 49 CONECT 14 13 15 50 CONECT 15 14 16 51 CONECT 16 15 17 52 CONECT 17 16 12 53 CONECT 18 3 CONECT 19 6 CONECT 20 5 21 54 55 CONECT 21 20 22 26 CONECT 22 21 23 56 CONECT 23 22 24 57 CONECT 24 23 25 58 CONECT 25 24 26 59 CONECT 26 25 21 60 CONECT 27 8 28 61 62 CONECT 28 27 29 30 63 CONECT 29 28 64 65 66 CONECT 30 28 67 68 69 CONECT 31 11 32 CONECT 32 31 33 37 CONECT 33 32 34 70 CONECT 34 33 35 71 CONECT 35 34 36 38 CONECT 36 35 37 72 CONECT 37 36 32 73 CONECT 38 35 CONECT 39 11 CONECT 40 11 CONECT 41 1 CONECT 42 1 CONECT 43 4 CONECT 44 5 CONECT 45 7 CONECT 46 8 CONECT 47 9 CONECT 48 10 CONECT 49 13 CONECT 50 14 CONECT 51 15 CONECT 52 16 CONECT 53 17 CONECT 54 20 CONECT 55 20 CONECT 56 22 CONECT 57 23 CONECT 58 24 CONECT 59 25 CONECT 60 26 CONECT 61 27 CONECT 62 27 CONECT 63 28 CONECT 64 29 CONECT 65 29 CONECT 66 29 CONECT 67 30 CONECT 68 30 CONECT 69 30 CONECT 70 33 CONECT 71 34 CONECT 72 36 CONECT 73 37 MASTER 0 0 0 0 0 0 0 0 73 0 73 0 END M END $$$$