D0HR8Y AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -3.524 0.678 -2.031 1.00 0.00 C HETATM 2 C UNL 1 -4.662 0.024 -2.772 1.00 0.00 C HETATM 3 C UNL 1 -4.185 -1.300 -3.345 1.00 0.00 C HETATM 4 C UNL 1 -3.710 -2.115 -2.116 1.00 0.00 C HETATM 5 C UNL 1 -2.294 -1.619 -0.941 1.00 0.00 C HETATM 6 C UNL 1 -2.239 -0.152 -1.729 1.00 0.00 C HETATM 7 C UNL 1 -4.931 -3.517 -2.028 1.00 0.00 C HETATM 8 C UNL 1 -4.693 -4.807 -1.032 1.00 0.00 C HETATM 9 C UNL 1 -3.083 -4.870 0.011 1.00 0.00 C HETATM 10 C UNL 1 -1.724 -3.218 0.046 1.00 0.00 C HETATM 11 C UNL 1 -2.967 -5.230 1.335 1.00 0.00 C HETATM 12 C UNL 1 -1.585 -5.283 0.052 1.00 0.00 C HETATM 13 C UNL 1 -0.387 -4.779 0.965 1.00 0.00 C HETATM 14 C UNL 1 -0.665 -3.324 1.157 1.00 0.00 C HETATM 15 C UNL 1 -4.033 -4.040 1.298 1.00 0.00 C HETATM 16 C UNL 1 -3.657 -3.073 -0.071 1.00 0.00 C HETATM 17 C UNL 1 -2.363 -4.097 -1.452 1.00 0.00 C HETATM 18 O UNL 1 -5.280 0.855 -3.729 1.00 0.00 O HETATM 19 C UNL 1 -6.398 -2.936 -1.681 1.00 0.00 C HETATM 20 O UNL 1 -4.698 -5.995 -1.922 1.00 0.00 O HETATM 21 C UNL 1 -7.618 -3.863 -1.606 1.00 0.00 C HETATM 22 C UNL 1 -1.243 -3.738 -2.749 1.00 0.00 C HETATM 23 C UNL 1 0.039 -2.864 -2.622 1.00 0.00 C HETATM 24 C UNL 1 -0.596 -5.014 -3.408 1.00 0.00 C HETATM 25 C UNL 1 -1.464 -6.009 -4.154 1.00 0.00 C HETATM 26 C UNL 1 -0.556 -7.102 -4.720 1.00 0.00 C HETATM 27 N UNL 1 -0.444 -8.239 -3.906 1.00 0.00 N HETATM 28 C UNL 1 -0.864 -0.962 -0.307 1.00 0.00 C HETATM 29 H UNL 1 -4.343 -1.533 -1.448 1.00 0.00 H HETATM 30 C UNL 1 -1.269 -6.820 -0.132 1.00 0.00 C HETATM 31 O UNL 1 0.040 -6.990 -5.781 1.00 0.00 O HETATM 32 S UNL 1 0.703 -9.429 -4.014 1.00 0.00 S HETATM 33 C UNL 1 0.359 -10.275 -5.548 1.00 0.00 C HETATM 34 O UNL 1 2.012 -8.822 -4.080 1.00 0.00 O HETATM 35 O UNL 1 0.372 -10.341 -2.937 1.00 0.00 O HETATM 36 H UNL 1 -3.913 1.010 -1.058 1.00 0.00 H HETATM 37 H UNL 1 -3.221 1.591 -2.556 1.00 0.00 H HETATM 38 H UNL 1 -5.453 -0.148 -2.024 1.00 0.00 H HETATM 39 H UNL 1 -3.462 -1.233 -4.159 1.00 0.00 H HETATM 40 H UNL 1 -5.066 -1.771 -3.807 1.00 0.00 H HETATM 41 H UNL 1 -1.644 -0.254 -2.646 1.00 0.00 H HETATM 42 H UNL 1 -1.822 0.680 -1.160 1.00 0.00 H HETATM 43 H UNL 1 -4.989 -3.896 -3.058 1.00 0.00 H HETATM 44 H UNL 1 -5.528 -5.046 -0.406 1.00 0.00 H HETATM 45 H UNL 1 -3.078 -5.858 -0.576 1.00 0.00 H HETATM 46 H UNL 1 -0.868 -3.356 -0.660 1.00 0.00 H HETATM 47 H UNL 1 -2.395 -4.843 2.166 1.00 0.00 H HETATM 48 H UNL 1 0.572 -4.979 0.469 1.00 0.00 H HETATM 49 H UNL 1 -0.362 -5.285 1.938 1.00 0.00 H HETATM 50 H UNL 1 -1.017 -3.026 2.142 1.00 0.00 H HETATM 51 H UNL 1 0.290 -2.815 0.958 1.00 0.00 H HETATM 52 H UNL 1 -5.090 -4.342 1.194 1.00 0.00 H HETATM 53 H UNL 1 -4.097 -3.437 2.209 1.00 0.00 H HETATM 54 H UNL 1 -3.228 -2.271 0.635 1.00 0.00 H HETATM 55 H UNL 1 -4.586 -2.584 -0.213 1.00 0.00 H HETATM 56 H UNL 1 -2.937 -4.784 -2.116 1.00 0.00 H HETATM 57 H UNL 1 -6.236 0.665 -3.660 1.00 0.00 H HETATM 58 H UNL 1 -6.655 -2.159 -2.404 1.00 0.00 H HETATM 59 H UNL 1 -6.374 -2.430 -0.709 1.00 0.00 H HETATM 60 H UNL 1 -5.631 -6.212 -2.095 1.00 0.00 H HETATM 61 H UNL 1 -7.482 -4.753 -0.989 1.00 0.00 H HETATM 62 H UNL 1 -7.958 -4.166 -2.599 1.00 0.00 H HETATM 63 H UNL 1 -8.451 -3.308 -1.147 1.00 0.00 H HETATM 64 H UNL 1 -1.846 -3.249 -3.522 1.00 0.00 H HETATM 65 H UNL 1 0.772 -3.278 -1.915 1.00 0.00 H HETATM 66 H UNL 1 -0.177 -1.828 -2.430 1.00 0.00 H HETATM 67 H UNL 1 0.576 -2.788 -3.580 1.00 0.00 H HETATM 68 H UNL 1 0.121 -4.668 -4.175 1.00 0.00 H HETATM 69 H UNL 1 0.029 -5.526 -2.667 1.00 0.00 H HETATM 70 H UNL 1 -1.967 -5.520 -4.998 1.00 0.00 H HETATM 71 H UNL 1 -2.222 -6.449 -3.508 1.00 0.00 H HETATM 72 H UNL 1 -0.931 -8.265 -3.015 1.00 0.00 H HETATM 73 H UNL 1 -0.601 0.104 -0.254 1.00 0.00 H HETATM 74 H UNL 1 0.073 -1.403 -0.655 1.00 0.00 H HETATM 75 H UNL 1 -0.916 -1.089 0.781 1.00 0.00 H HETATM 76 H UNL 1 -0.686 -7.188 0.715 1.00 0.00 H HETATM 77 H UNL 1 -0.744 -7.028 -1.052 1.00 0.00 H HETATM 78 H UNL 1 -2.186 -7.446 -0.083 1.00 0.00 H HETATM 79 H UNL 1 0.407 -9.576 -6.381 1.00 0.00 H HETATM 80 H UNL 1 -0.617 -10.758 -5.483 1.00 0.00 H HETATM 81 H UNL 1 1.132 -11.040 -5.676 1.00 0.00 H CONECT 1 2 6 36 37 CONECT 2 1 3 18 38 CONECT 3 2 4 39 40 CONECT 4 3 5 7 29 CONECT 5 4 6 10 28 CONECT 6 5 1 41 42 CONECT 7 4 8 19 43 CONECT 8 7 9 20 44 CONECT 9 8 10 11 45 CONECT 10 9 5 14 46 CONECT 11 9 12 15 47 CONECT 12 11 13 17 30 CONECT 13 12 14 48 49 CONECT 14 13 10 50 51 CONECT 15 11 16 52 53 CONECT 16 15 17 54 55 CONECT 17 16 12 22 56 CONECT 18 2 57 CONECT 19 7 21 58 59 CONECT 20 8 60 CONECT 21 19 61 62 63 CONECT 22 17 24 23 64 CONECT 23 22 65 66 67 CONECT 24 25 22 68 69 CONECT 25 24 26 70 71 CONECT 26 25 27 31 CONECT 27 26 32 72 CONECT 28 5 73 74 75 CONECT 29 4 CONECT 30 12 76 77 78 CONECT 31 26 CONECT 32 27 33 34 35 CONECT 33 32 79 80 81 CONECT 34 32 CONECT 35 32 CONECT 36 1 CONECT 37 1 CONECT 38 2 CONECT 39 3 CONECT 40 3 CONECT 41 6 CONECT 42 6 CONECT 43 7 CONECT 44 8 CONECT 45 9 CONECT 46 10 CONECT 47 11 CONECT 48 13 CONECT 49 13 CONECT 50 14 CONECT 51 14 CONECT 52 15 CONECT 53 15 CONECT 54 16 CONECT 55 16 CONECT 56 17 CONECT 57 18 CONECT 58 19 CONECT 59 19 CONECT 60 20 CONECT 61 21 CONECT 62 21 CONECT 63 21 CONECT 64 22 CONECT 65 23 CONECT 66 23 CONECT 67 23 CONECT 68 24 CONECT 69 24 CONECT 70 25 CONECT 71 25 CONECT 72 27 CONECT 73 28 CONECT 74 28 CONECT 75 28 CONECT 76 30 CONECT 77 30 CONECT 78 30 CONECT 79 33 CONECT 80 33 CONECT 81 33 MASTER 0 0 0 0 0 0 0 0 81 0 81 0 END M END $$$$