D0P3EG AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -0.118 -0.739 -0.223 1.00 0.00 C HETATM 2 N UNL 1 -1.353 -1.182 -0.356 1.00 0.00 N HETATM 3 N UNL 1 -2.179 -0.104 -0.402 1.00 0.00 N HETATM 4 C UNL 1 -1.426 0.963 -0.316 1.00 0.00 C HETATM 5 O UNL 1 -0.071 0.655 -0.204 1.00 0.00 O HETATM 6 C UNL 1 1.005 -1.530 0.317 1.00 0.00 C HETATM 7 C UNL 1 -1.892 2.412 -0.450 1.00 0.00 C HETATM 8 N UNL 1 -1.258 2.914 -1.731 1.00 0.00 N HETATM 9 S UNL 1 -1.600 4.420 -2.321 1.00 0.00 S HETATM 10 C UNL 1 -1.597 5.650 -1.012 1.00 0.00 C HETATM 11 O UNL 1 -0.507 4.756 -3.280 1.00 0.00 O HETATM 12 O UNL 1 -2.937 4.332 -2.812 1.00 0.00 O HETATM 13 C UNL 1 0.588 -2.611 1.119 1.00 0.00 C HETATM 14 C UNL 1 1.279 -2.919 2.279 1.00 0.00 C HETATM 15 C UNL 1 2.392 -2.152 2.578 1.00 0.00 C HETATM 16 C UNL 1 3.047 -1.495 1.543 1.00 0.00 C HETATM 17 C UNL 1 2.354 -1.188 0.370 1.00 0.00 C HETATM 18 O UNL 1 3.093 -0.503 -0.550 1.00 0.00 O HETATM 19 C UNL 1 2.743 -0.696 -1.918 1.00 0.00 C HETATM 20 C UNL 1 -3.457 2.491 -0.449 1.00 0.00 C HETATM 21 C UNL 1 -4.229 2.052 0.839 1.00 0.00 C HETATM 22 C UNL 1 -3.994 2.960 2.059 1.00 0.00 C HETATM 23 O UNL 1 -3.200 3.885 2.004 1.00 0.00 O HETATM 24 N UNL 1 -4.723 2.651 3.203 1.00 0.00 N HETATM 25 C UNL 1 -4.531 3.468 4.401 1.00 0.00 C HETATM 26 C UNL 1 -5.346 3.146 5.650 1.00 0.00 C HETATM 27 C UNL 1 -1.043 7.042 -1.174 1.00 0.00 C HETATM 28 C UNL 1 -2.503 6.804 -1.394 1.00 0.00 C HETATM 29 C UNL 1 -5.385 4.054 6.685 1.00 0.00 C HETATM 30 N UNL 1 -6.065 3.896 7.849 1.00 0.00 N HETATM 31 C UNL 1 -6.909 2.847 7.911 1.00 0.00 C HETATM 32 C UNL 1 -7.053 1.970 6.860 1.00 0.00 C HETATM 33 C UNL 1 -6.064 1.972 5.863 1.00 0.00 C HETATM 34 H UNL 1 -1.480 3.000 0.372 1.00 0.00 H HETATM 35 H UNL 1 -1.392 2.243 -2.495 1.00 0.00 H HETATM 36 H UNL 1 -1.594 5.261 -0.008 1.00 0.00 H HETATM 37 H UNL 1 -0.387 -3.072 0.970 1.00 0.00 H HETATM 38 H UNL 1 0.872 -3.628 2.990 1.00 0.00 H HETATM 39 H UNL 1 2.705 -2.020 3.607 1.00 0.00 H HETATM 40 H UNL 1 4.078 -1.169 1.682 1.00 0.00 H HETATM 41 H UNL 1 3.601 -1.124 -2.455 1.00 0.00 H HETATM 42 H UNL 1 2.542 0.289 -2.333 1.00 0.00 H HETATM 43 H UNL 1 1.883 -1.348 -2.091 1.00 0.00 H HETATM 44 H UNL 1 -3.839 1.884 -1.286 1.00 0.00 H HETATM 45 H UNL 1 -3.776 3.519 -0.663 1.00 0.00 H HETATM 46 H UNL 1 -3.990 1.019 1.107 1.00 0.00 H HETATM 47 H UNL 1 -5.302 2.087 0.606 1.00 0.00 H HETATM 48 H UNL 1 -5.462 1.969 3.169 1.00 0.00 H HETATM 49 H UNL 1 -4.789 4.491 4.121 1.00 0.00 H HETATM 50 H UNL 1 -3.479 3.442 4.659 1.00 0.00 H HETATM 51 H UNL 1 -0.432 7.309 -2.029 1.00 0.00 H HETATM 52 H UNL 1 -0.784 7.590 -0.272 1.00 0.00 H HETATM 53 H UNL 1 -2.840 6.940 -2.415 1.00 0.00 H HETATM 54 H UNL 1 -3.247 7.064 -0.650 1.00 0.00 H HETATM 55 H UNL 1 -4.841 5.001 6.624 1.00 0.00 H HETATM 56 H UNL 1 -7.446 2.735 8.828 1.00 0.00 H HETATM 57 H UNL 1 -7.907 1.323 6.803 1.00 0.00 H HETATM 58 H UNL 1 -5.857 1.070 5.296 1.00 0.00 H CONECT 1 2 5 6 CONECT 2 1 3 CONECT 3 2 4 CONECT 4 3 5 7 CONECT 5 4 1 CONECT 6 1 13 17 CONECT 7 4 8 20 34 CONECT 8 7 9 35 CONECT 9 8 10 11 12 CONECT 10 9 27 28 36 CONECT 11 9 CONECT 12 9 CONECT 13 6 14 37 CONECT 14 13 15 38 CONECT 15 14 16 39 CONECT 16 15 17 40 CONECT 17 16 6 18 CONECT 18 17 19 CONECT 19 18 41 42 43 CONECT 20 7 21 44 45 CONECT 21 20 22 46 47 CONECT 22 21 23 24 CONECT 23 22 CONECT 24 22 25 48 CONECT 25 24 26 49 50 CONECT 26 25 29 33 CONECT 27 10 28 51 52 CONECT 28 27 10 53 54 CONECT 29 26 30 55 CONECT 30 29 31 CONECT 31 30 32 56 CONECT 32 31 33 57 CONECT 33 32 26 58 CONECT 34 7 CONECT 35 8 CONECT 36 10 CONECT 37 13 CONECT 38 14 CONECT 39 15 CONECT 40 16 CONECT 41 19 CONECT 42 19 CONECT 43 19 CONECT 44 20 CONECT 45 20 CONECT 46 21 CONECT 47 21 CONECT 48 24 CONECT 49 25 CONECT 50 25 CONECT 51 27 CONECT 52 27 CONECT 53 28 CONECT 54 28 CONECT 55 29 CONECT 56 31 CONECT 57 32 CONECT 58 33 MASTER 0 0 0 0 0 0 0 0 58 0 58 0 END M END $$$$