D0O3KN AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 4.443 1.908 1.952 1.00 0.00 C HETATM 2 C UNL 1 5.536 2.631 1.493 1.00 0.00 C HETATM 3 C UNL 1 5.903 2.515 0.156 1.00 0.00 C HETATM 4 C UNL 1 5.328 1.525 -0.645 1.00 0.00 C HETATM 5 C UNL 1 4.771 0.467 0.087 1.00 0.00 C HETATM 6 C UNL 1 4.048 0.794 1.235 1.00 0.00 C HETATM 7 C UNL 1 5.517 1.447 -2.049 1.00 0.00 C HETATM 8 C UNL 1 5.594 0.164 -2.547 1.00 0.00 C HETATM 9 C UNL 1 5.653 -0.917 -1.602 1.00 0.00 C HETATM 10 C UNL 1 5.222 -0.812 -0.250 1.00 0.00 C HETATM 11 N UNL 1 5.826 -1.701 0.817 1.00 0.00 N HETATM 12 S UNL 1 4.864 -2.630 2.016 1.00 0.00 S HETATM 13 O UNL 1 5.577 -2.581 3.287 1.00 0.00 O HETATM 14 O UNL 1 3.464 -2.275 1.920 1.00 0.00 O HETATM 15 C UNL 1 4.964 -4.450 1.437 1.00 0.00 C HETATM 16 C UNL 1 5.597 -4.409 0.224 1.00 0.00 C HETATM 17 C UNL 1 6.997 -4.528 0.261 1.00 0.00 C HETATM 18 C UNL 1 7.639 -5.031 1.424 1.00 0.00 C HETATM 19 C UNL 1 6.814 -5.616 2.402 1.00 0.00 C HETATM 20 C UNL 1 5.429 -5.479 2.274 1.00 0.00 C HETATM 21 C UNL 1 9.108 -4.981 1.648 1.00 0.00 C HETATM 22 C UNL 1 4.706 -4.065 -0.909 1.00 0.00 C HETATM 23 C UNL 1 4.712 -6.838 2.152 1.00 0.00 C HETATM 24 C UNL 1 7.120 -1.283 1.449 1.00 0.00 C HETATM 25 O UNL 1 5.541 2.655 -2.702 1.00 0.00 O HETATM 26 C UNL 1 5.951 2.956 -4.069 1.00 0.00 C HETATM 27 C UNL 1 4.999 4.064 -4.596 1.00 0.00 C HETATM 28 C UNL 1 3.648 3.564 -5.002 1.00 0.00 C HETATM 29 O UNL 1 3.249 3.553 -6.164 1.00 0.00 O HETATM 30 O UNL 1 2.878 3.166 -3.973 1.00 0.00 O HETATM 31 C UNL 1 7.344 3.632 -4.079 1.00 0.00 C HETATM 32 C UNL 1 8.145 3.721 -5.242 1.00 0.00 C HETATM 33 C UNL 1 9.350 4.468 -5.256 1.00 0.00 C HETATM 34 C UNL 1 9.768 5.158 -4.115 1.00 0.00 C HETATM 35 C UNL 1 8.969 5.083 -2.973 1.00 0.00 C HETATM 36 C UNL 1 7.788 4.335 -2.954 1.00 0.00 C HETATM 37 N UNL 1 10.928 5.958 -3.997 1.00 0.00 N HETATM 38 C UNL 1 11.951 6.162 -4.902 1.00 0.00 C HETATM 39 O UNL 1 12.039 5.685 -6.026 1.00 0.00 O HETATM 40 C UNL 1 13.042 7.064 -4.345 1.00 0.00 C HETATM 41 C UNL 1 8.259 -0.623 0.710 1.00 0.00 C HETATM 42 O UNL 1 8.323 -0.428 -0.503 1.00 0.00 O HETATM 43 O UNL 1 9.303 -0.315 1.552 1.00 0.00 O HETATM 44 H UNL 1 3.972 2.137 2.900 1.00 0.00 H HETATM 45 H UNL 1 6.079 3.295 2.156 1.00 0.00 H HETATM 46 H UNL 1 6.743 3.083 -0.234 1.00 0.00 H HETATM 47 H UNL 1 3.227 0.167 1.572 1.00 0.00 H HETATM 48 H UNL 1 5.756 -0.037 -3.600 1.00 0.00 H HETATM 49 H UNL 1 6.156 -1.816 -1.941 1.00 0.00 H HETATM 50 H UNL 1 7.596 -4.193 -0.579 1.00 0.00 H HETATM 51 H UNL 1 7.248 -6.362 3.074 1.00 0.00 H HETATM 52 H UNL 1 9.431 -3.940 1.762 1.00 0.00 H HETATM 53 H UNL 1 9.651 -5.449 0.826 1.00 0.00 H HETATM 54 H UNL 1 9.389 -5.498 2.576 1.00 0.00 H HETATM 55 H UNL 1 4.254 -4.973 -1.319 1.00 0.00 H HETATM 56 H UNL 1 5.218 -3.547 -1.710 1.00 0.00 H HETATM 57 H UNL 1 3.869 -3.432 -0.573 1.00 0.00 H HETATM 58 H UNL 1 5.386 -7.683 2.353 1.00 0.00 H HETATM 59 H UNL 1 4.375 -6.985 1.115 1.00 0.00 H HETATM 60 H UNL 1 3.853 -6.909 2.817 1.00 0.00 H HETATM 61 H UNL 1 7.592 -2.189 1.847 1.00 0.00 H HETATM 62 H UNL 1 6.882 -0.612 2.291 1.00 0.00 H HETATM 63 H UNL 1 5.915 2.067 -4.708 1.00 0.00 H HETATM 64 H UNL 1 5.414 4.564 -5.486 1.00 0.00 H HETATM 65 H UNL 1 4.844 4.862 -3.856 1.00 0.00 H HETATM 66 H UNL 1 3.330 3.224 -3.105 1.00 0.00 H HETATM 67 H UNL 1 7.827 3.247 -6.171 1.00 0.00 H HETATM 68 H UNL 1 9.926 4.523 -6.179 1.00 0.00 H HETATM 69 H UNL 1 9.250 5.603 -2.063 1.00 0.00 H HETATM 70 H UNL 1 7.189 4.375 -2.039 1.00 0.00 H HETATM 71 H UNL 1 11.033 6.421 -3.105 1.00 0.00 H HETATM 72 H UNL 1 12.781 7.477 -3.365 1.00 0.00 H HETATM 73 H UNL 1 13.214 7.903 -5.025 1.00 0.00 H HETATM 74 H UNL 1 13.967 6.490 -4.231 1.00 0.00 H HETATM 75 H UNL 1 9.154 -0.555 2.483 1.00 0.00 H CONECT 1 2 6 44 CONECT 2 1 3 45 CONECT 3 2 4 46 CONECT 4 3 5 7 CONECT 5 4 6 10 CONECT 6 5 1 47 CONECT 7 4 8 25 CONECT 8 7 9 48 CONECT 9 8 10 49 CONECT 10 9 5 11 CONECT 11 10 12 24 CONECT 12 11 13 14 15 CONECT 13 12 CONECT 14 12 CONECT 15 12 16 20 CONECT 16 15 17 22 CONECT 17 16 18 50 CONECT 18 17 19 21 CONECT 19 18 20 51 CONECT 20 19 15 23 CONECT 21 18 52 53 54 CONECT 22 16 55 56 57 CONECT 23 20 58 59 60 CONECT 24 11 41 61 62 CONECT 25 7 26 CONECT 26 25 27 31 63 CONECT 27 26 28 64 65 CONECT 28 27 29 30 CONECT 29 28 CONECT 30 28 66 CONECT 31 26 32 36 CONECT 32 31 33 67 CONECT 33 32 34 68 CONECT 34 33 35 37 CONECT 35 34 36 69 CONECT 36 35 31 70 CONECT 37 34 38 71 CONECT 38 37 39 40 CONECT 39 38 CONECT 40 38 72 73 74 CONECT 41 24 42 43 CONECT 42 41 CONECT 43 41 75 CONECT 44 1 CONECT 45 2 CONECT 46 3 CONECT 47 6 CONECT 48 8 CONECT 49 9 CONECT 50 17 CONECT 51 19 CONECT 52 21 CONECT 53 21 CONECT 54 21 CONECT 55 22 CONECT 56 22 CONECT 57 22 CONECT 58 23 CONECT 59 23 CONECT 60 23 CONECT 61 24 CONECT 62 24 CONECT 63 26 CONECT 64 27 CONECT 65 27 CONECT 66 30 CONECT 67 32 CONECT 68 33 CONECT 69 35 CONECT 70 36 CONECT 71 37 CONECT 72 40 CONECT 73 40 CONECT 74 40 CONECT 75 43 MASTER 0 0 0 0 0 0 0 0 75 0 75 0 END M END $$$$