D0YX4R AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 -3.736 4.273 -1.542 1.00 0.00 N HETATM 2 C UNL 1 -4.409 3.267 -0.687 1.00 0.00 C HETATM 3 C UNL 1 -4.744 1.891 -1.329 1.00 0.00 C HETATM 4 N UNL 1 -3.795 1.478 -2.350 1.00 0.00 N HETATM 5 C UNL 1 -3.645 2.481 -3.383 1.00 0.00 C HETATM 6 C UNL 1 -3.236 3.856 -2.867 1.00 0.00 C HETATM 7 C UNL 1 -3.133 5.377 -0.970 1.00 0.00 C HETATM 8 N UNL 1 -2.310 6.087 -1.772 1.00 0.00 N HETATM 9 N UNL 1 -3.268 5.829 0.231 1.00 0.00 N HETATM 10 C UNL 1 -3.799 0.083 -2.783 1.00 0.00 C HETATM 11 C UNL 1 -4.893 -0.507 -3.652 1.00 0.00 C HETATM 12 C UNL 1 -5.907 0.186 -4.296 1.00 0.00 C HETATM 13 C UNL 1 -7.055 -0.501 -4.736 1.00 0.00 C HETATM 14 C UNL 1 -6.940 -1.856 -5.025 1.00 0.00 C HETATM 15 C UNL 1 -5.686 -2.430 -4.875 1.00 0.00 C HETATM 16 C UNL 1 -4.916 -1.887 -3.845 1.00 0.00 C HETATM 17 C UNL 1 -8.453 0.055 -4.702 1.00 0.00 C HETATM 18 N UNL 1 -8.656 1.200 -3.932 1.00 0.00 N HETATM 19 O UNL 1 -9.379 -0.605 -5.166 1.00 0.00 O HETATM 20 C UNL 1 -9.982 1.430 -3.320 1.00 0.00 C HETATM 21 C UNL 1 -9.920 2.507 -2.194 1.00 0.00 C HETATM 22 N UNL 1 -9.009 3.661 -2.453 1.00 0.00 N HETATM 23 C UNL 1 -7.850 3.364 -3.280 1.00 0.00 C HETATM 24 C UNL 1 -8.092 2.421 -4.426 1.00 0.00 C HETATM 25 C UNL 1 -8.877 4.645 -1.434 1.00 0.00 C HETATM 26 C UNL 1 -7.790 5.696 -1.542 1.00 0.00 C HETATM 27 O UNL 1 -9.564 4.613 -0.396 1.00 0.00 O HETATM 28 C UNL 1 -7.424 6.253 -2.773 1.00 0.00 C HETATM 29 C UNL 1 -6.268 7.036 -2.926 1.00 0.00 C HETATM 30 C UNL 1 -5.551 7.452 -1.812 1.00 0.00 C HETATM 31 C UNL 1 -6.014 7.049 -0.541 1.00 0.00 C HETATM 32 C UNL 1 -7.090 6.139 -0.413 1.00 0.00 C HETATM 33 C UNL 1 -4.314 8.293 -1.967 1.00 0.00 C HETATM 34 N UNL 1 -3.734 8.906 -0.895 1.00 0.00 N HETATM 35 N UNL 1 -3.671 8.452 -3.085 1.00 0.00 N HETATM 36 N UNL 1 -4.936 -2.469 -6.183 1.00 0.00 N1+ HETATM 37 O UNL 1 -5.535 -2.150 -7.223 1.00 0.00 O HETATM 38 O UNL 1 -3.725 -2.760 -6.135 1.00 0.00 O1- HETATM 39 H UNL 1 -5.342 3.699 -0.303 1.00 0.00 H HETATM 40 H UNL 1 -3.772 3.075 0.184 1.00 0.00 H HETATM 41 H UNL 1 -5.751 1.905 -1.741 1.00 0.00 H HETATM 42 H UNL 1 -4.786 1.155 -0.515 1.00 0.00 H HETATM 43 H UNL 1 -4.564 2.626 -3.949 1.00 0.00 H HETATM 44 H UNL 1 -2.879 2.170 -4.102 1.00 0.00 H HETATM 45 H UNL 1 -2.149 3.892 -2.870 1.00 0.00 H HETATM 46 H UNL 1 -3.605 4.593 -3.602 1.00 0.00 H HETATM 47 H UNL 1 -2.734 6.359 -2.654 1.00 0.00 H HETATM 48 H UNL 1 -2.031 6.946 -1.321 1.00 0.00 H HETATM 49 H UNL 1 -3.915 5.231 0.744 1.00 0.00 H HETATM 50 H UNL 1 -3.747 -0.535 -1.878 1.00 0.00 H HETATM 51 H UNL 1 -2.851 -0.089 -3.309 1.00 0.00 H HETATM 52 H UNL 1 -5.824 1.248 -4.365 1.00 0.00 H HETATM 53 H UNL 1 -7.765 -2.431 -5.422 1.00 0.00 H HETATM 54 H UNL 1 -4.432 -2.550 -3.132 1.00 0.00 H HETATM 55 H UNL 1 -10.382 0.512 -2.961 1.00 0.00 H HETATM 56 H UNL 1 -10.637 1.784 -4.136 1.00 0.00 H HETATM 57 H UNL 1 -9.594 2.016 -1.267 1.00 0.00 H HETATM 58 H UNL 1 -10.927 2.897 -2.011 1.00 0.00 H HETATM 59 H UNL 1 -7.066 3.007 -2.607 1.00 0.00 H HETATM 60 H UNL 1 -7.456 4.239 -3.769 1.00 0.00 H HETATM 61 H UNL 1 -8.793 2.844 -5.148 1.00 0.00 H HETATM 62 H UNL 1 -7.181 2.286 -4.994 1.00 0.00 H HETATM 63 H UNL 1 -8.012 6.057 -3.660 1.00 0.00 H HETATM 64 H UNL 1 -5.975 7.321 -3.932 1.00 0.00 H HETATM 65 H UNL 1 -5.505 7.384 0.356 1.00 0.00 H HETATM 66 H UNL 1 -7.352 5.778 0.581 1.00 0.00 H HETATM 67 H UNL 1 -3.606 8.302 -0.086 1.00 0.00 H HETATM 68 H UNL 1 -2.851 9.337 -1.157 1.00 0.00 H HETATM 69 H UNL 1 -4.126 7.969 -3.879 1.00 0.00 H CONECT 1 2 6 7 CONECT 2 1 3 39 40 CONECT 3 2 4 41 42 CONECT 4 3 5 10 CONECT 5 4 6 43 44 CONECT 6 5 1 45 46 CONECT 7 1 8 9 CONECT 8 7 47 48 CONECT 9 7 49 CONECT 10 4 11 50 51 CONECT 11 10 12 16 CONECT 12 11 13 52 CONECT 13 12 14 17 CONECT 14 13 15 53 CONECT 15 36 14 16 CONECT 16 15 11 54 CONECT 17 13 18 19 CONECT 18 17 20 24 CONECT 19 17 CONECT 20 18 21 55 56 CONECT 21 20 22 57 58 CONECT 22 21 23 25 CONECT 23 22 24 59 60 CONECT 24 23 18 61 62 CONECT 25 22 26 27 CONECT 26 25 28 32 CONECT 27 25 CONECT 28 26 29 63 CONECT 29 28 30 64 CONECT 30 29 31 33 CONECT 31 30 32 65 CONECT 32 31 26 66 CONECT 33 30 34 35 CONECT 34 33 67 68 CONECT 35 33 69 CONECT 36 37 38 15 CONECT 37 36 CONECT 38 36 CONECT 39 2 CONECT 40 2 CONECT 41 3 CONECT 42 3 CONECT 43 5 CONECT 44 5 CONECT 45 6 CONECT 46 6 CONECT 47 8 CONECT 48 8 CONECT 49 9 CONECT 50 10 CONECT 51 10 CONECT 52 12 CONECT 53 14 CONECT 54 16 CONECT 55 20 CONECT 56 20 CONECT 57 21 CONECT 58 21 CONECT 59 23 CONECT 60 23 CONECT 61 24 CONECT 62 24 CONECT 63 28 CONECT 64 29 CONECT 65 31 CONECT 66 32 CONECT 67 34 CONECT 68 34 CONECT 69 35 MASTER 0 0 0 0 0 0 0 0 69 0 69 0 END M END $$$$