D0AY8W AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 2.082 -3.348 2.498 1.00 0.00 N HETATM 2 C UNL 1 0.950 -2.497 1.873 1.00 0.00 C HETATM 3 C UNL 1 -0.656 -2.612 2.016 1.00 0.00 C HETATM 4 C UNL 1 -1.466 -3.316 2.923 1.00 0.00 C HETATM 5 C UNL 1 -2.959 -3.241 2.943 1.00 0.00 C HETATM 6 C UNL 1 -3.729 -2.446 2.062 1.00 0.00 C HETATM 7 C UNL 1 -2.908 -1.734 1.150 1.00 0.00 C HETATM 8 C UNL 1 -1.448 -1.824 1.127 1.00 0.00 C HETATM 9 C UNL 1 3.472 -2.847 2.064 1.00 0.00 C HETATM 10 C UNL 1 4.812 -3.416 2.772 1.00 0.00 C HETATM 11 N UNL 1 4.673 -3.706 4.205 1.00 0.00 N HETATM 12 C UNL 1 3.314 -4.100 4.589 1.00 0.00 C HETATM 13 C UNL 1 2.125 -3.303 3.967 1.00 0.00 C HETATM 14 C UNL 1 5.681 -4.240 5.077 1.00 0.00 C HETATM 15 C UNL 1 7.185 -4.042 5.048 1.00 0.00 C HETATM 16 O UNL 1 5.301 -4.879 6.075 1.00 0.00 O HETATM 17 C UNL 1 7.694 -3.939 6.357 1.00 0.00 C HETATM 18 C UNL 1 8.350 -2.771 6.731 1.00 0.00 C HETATM 19 C UNL 1 8.600 -1.846 5.736 1.00 0.00 C HETATM 20 N UNL 1 8.451 -2.122 4.422 1.00 0.00 N HETATM 21 C UNL 1 7.932 -3.336 4.123 1.00 0.00 C HETATM 22 N UNL 1 8.896 -4.093 3.359 1.00 0.00 N HETATM 23 H UNL 1 8.941 -0.841 5.974 1.00 0.00 H HETATM 24 C UNL 1 -5.341 -2.257 1.985 1.00 0.00 C HETATM 25 N UNL 1 -6.239 -3.034 2.771 1.00 0.00 N HETATM 26 O UNL 1 -5.763 -1.395 1.197 1.00 0.00 O HETATM 27 C UNL 1 -7.728 -3.063 2.821 1.00 0.00 C HETATM 28 C UNL 1 -8.662 -2.325 2.084 1.00 0.00 C HETATM 29 C UNL 1 -10.111 -2.501 2.222 1.00 0.00 C HETATM 30 C UNL 1 -10.691 -3.432 3.109 1.00 0.00 C HETATM 31 C UNL 1 -9.763 -4.168 3.841 1.00 0.00 C HETATM 32 C UNL 1 -8.341 -3.988 3.707 1.00 0.00 C HETATM 33 C UNL 1 -12.161 -3.707 3.218 1.00 0.00 C HETATM 34 C UNL 1 -13.344 -3.988 3.335 1.00 0.00 C HETATM 35 C UNL 1 -14.603 -4.700 3.259 1.00 0.00 C HETATM 36 C UNL 1 -15.720 -4.462 4.077 1.00 0.00 C HETATM 37 C UNL 1 -16.935 -5.165 3.867 1.00 0.00 C HETATM 38 C UNL 1 -16.977 -6.238 2.995 1.00 0.00 C HETATM 39 C UNL 1 -15.775 -6.644 2.450 1.00 0.00 C HETATM 40 C UNL 1 -14.696 -5.764 2.364 1.00 0.00 C HETATM 41 H UNL 1 1.106 -2.649 0.794 1.00 0.00 H HETATM 42 H UNL 1 1.183 -1.445 2.084 1.00 0.00 H HETATM 43 H UNL 1 -0.993 -3.959 3.663 1.00 0.00 H HETATM 44 H UNL 1 -3.469 -3.831 3.700 1.00 0.00 H HETATM 45 H UNL 1 -3.384 -1.082 0.420 1.00 0.00 H HETATM 46 H UNL 1 -0.942 -1.227 0.364 1.00 0.00 H HETATM 47 H UNL 1 3.507 -1.758 2.209 1.00 0.00 H HETATM 48 H UNL 1 3.592 -3.023 0.987 1.00 0.00 H HETATM 49 H UNL 1 5.633 -2.701 2.638 1.00 0.00 H HETATM 50 H UNL 1 5.122 -4.349 2.286 1.00 0.00 H HETATM 51 H UNL 1 3.223 -4.004 5.677 1.00 0.00 H HETATM 52 H UNL 1 3.226 -5.165 4.341 1.00 0.00 H HETATM 53 H UNL 1 1.214 -3.757 4.357 1.00 0.00 H HETATM 54 H UNL 1 2.175 -2.266 4.318 1.00 0.00 H HETATM 55 H UNL 1 7.374 -4.628 7.140 1.00 0.00 H HETATM 56 H UNL 1 8.549 -2.555 7.774 1.00 0.00 H HETATM 57 H UNL 1 9.493 -3.372 2.935 1.00 0.00 H HETATM 58 H UNL 1 9.478 -4.597 4.031 1.00 0.00 H HETATM 59 H UNL 1 -5.798 -3.689 3.405 1.00 0.00 H HETATM 60 H UNL 1 -8.323 -1.580 1.371 1.00 0.00 H HETATM 61 H UNL 1 -10.770 -1.887 1.610 1.00 0.00 H HETATM 62 H UNL 1 -10.114 -4.889 4.581 1.00 0.00 H HETATM 63 H UNL 1 -7.721 -4.593 4.360 1.00 0.00 H HETATM 64 H UNL 1 -15.700 -3.723 4.872 1.00 0.00 H HETATM 65 H UNL 1 -17.835 -4.928 4.431 1.00 0.00 H HETATM 66 H UNL 1 -17.885 -6.808 2.809 1.00 0.00 H HETATM 67 H UNL 1 -15.548 -7.714 2.486 1.00 0.00 H HETATM 68 H UNL 1 -13.912 -5.949 1.637 1.00 0.00 H CONECT 1 2 9 13 CONECT 2 1 3 41 42 CONECT 3 2 4 8 CONECT 4 3 5 43 CONECT 5 4 6 44 CONECT 6 5 7 24 CONECT 7 6 8 45 CONECT 8 7 3 46 CONECT 9 1 10 47 48 CONECT 10 9 11 49 50 CONECT 11 10 12 14 CONECT 12 11 13 51 52 CONECT 13 12 1 53 54 CONECT 14 11 15 16 CONECT 15 14 17 21 CONECT 16 14 CONECT 17 15 18 55 CONECT 18 17 19 56 CONECT 19 18 20 23 CONECT 20 19 21 CONECT 21 20 15 22 CONECT 22 21 57 58 CONECT 23 19 CONECT 24 6 25 26 CONECT 25 24 27 59 CONECT 26 24 CONECT 27 25 28 32 CONECT 28 27 29 60 CONECT 29 28 30 61 CONECT 30 29 31 33 CONECT 31 30 32 62 CONECT 32 31 27 63 CONECT 33 30 34 CONECT 34 33 35 CONECT 35 34 36 40 CONECT 36 35 37 64 CONECT 37 36 38 65 CONECT 38 37 39 66 CONECT 39 38 40 67 CONECT 40 39 35 68 CONECT 41 2 CONECT 42 2 CONECT 43 4 CONECT 44 5 CONECT 45 7 CONECT 46 8 CONECT 47 9 CONECT 48 9 CONECT 49 10 CONECT 50 10 CONECT 51 12 CONECT 52 12 CONECT 53 13 CONECT 54 13 CONECT 55 17 CONECT 56 18 CONECT 57 22 CONECT 58 22 CONECT 59 25 CONECT 60 28 CONECT 61 29 CONECT 62 31 CONECT 63 32 CONECT 64 36 CONECT 65 37 CONECT 66 38 CONECT 67 39 CONECT 68 40 MASTER 0 0 0 0 0 0 0 0 68 0 68 0 END M END $$$$