D0VB3P AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.931 0.070 0.019 1.00 0.00 C HETATM 2 C UNL 1 -1.949 -3.589 3.410 1.00 0.00 C HETATM 3 C UNL 1 -1.229 -2.675 2.562 1.00 0.00 C HETATM 4 C UNL 1 -2.412 -1.856 2.689 1.00 0.00 C HETATM 5 C UNL 1 -1.996 -0.432 1.639 1.00 0.00 C HETATM 6 C UNL 1 -0.604 0.479 0.655 1.00 0.00 C HETATM 7 O UNL 1 0.054 -2.326 2.828 1.00 0.00 O HETATM 8 C UNL 1 0.778 -3.423 3.443 1.00 0.00 C HETATM 9 C UNL 1 2.239 -3.395 3.051 1.00 0.00 C HETATM 10 N UNL 1 -4.098 -2.652 3.377 1.00 0.00 N HETATM 11 C UNL 1 -5.419 -3.050 4.593 1.00 0.00 C HETATM 12 C UNL 1 -6.494 -4.403 5.437 1.00 0.00 C HETATM 13 C UNL 1 -8.060 -4.261 6.396 1.00 0.00 C HETATM 14 C UNL 1 -8.349 -3.023 5.976 1.00 0.00 C HETATM 15 C UNL 1 -7.338 -2.155 5.299 1.00 0.00 C HETATM 16 N UNL 1 -5.970 -1.982 4.986 1.00 0.00 N HETATM 17 N UNL 1 -9.548 -5.208 6.972 1.00 0.00 N HETATM 18 C UNL 1 -11.286 -5.158 6.414 1.00 0.00 C HETATM 19 C UNL 1 -11.431 -4.127 5.553 1.00 0.00 C HETATM 20 C UNL 1 -10.219 -3.923 4.824 1.00 0.00 C HETATM 21 N UNL 1 -9.549 -2.810 5.317 1.00 0.00 N HETATM 22 O UNL 1 -9.768 -4.868 4.176 1.00 0.00 O HETATM 23 C UNL 1 -10.209 -5.286 8.561 1.00 0.00 C HETATM 24 C UNL 1 -10.000 -1.424 5.522 1.00 0.00 C HETATM 25 C UNL 1 2.609 0.012 0.752 1.00 0.00 C HETATM 26 O UNL 1 2.784 -0.511 1.850 1.00 0.00 O HETATM 27 N UNL 1 4.013 0.633 -0.026 1.00 0.00 N HETATM 28 C UNL 1 -12.583 -5.191 7.274 1.00 0.00 C HETATM 29 C UNL 1 -13.440 -4.020 7.551 1.00 0.00 C HETATM 30 C UNL 1 -13.053 -2.834 7.021 1.00 0.00 C HETATM 31 C UNL 1 -11.945 -2.994 6.232 1.00 0.00 C HETATM 32 C UNL 1 5.576 0.394 0.357 1.00 0.00 C HETATM 33 C UNL 1 6.889 1.139 -0.653 1.00 0.00 C HETATM 34 C UNL 1 6.561 2.457 -1.548 1.00 0.00 C HETATM 35 C UNL 1 4.992 2.223 -1.772 1.00 0.00 C HETATM 36 C UNL 1 4.086 2.025 -0.483 1.00 0.00 C HETATM 37 N UNL 1 7.220 3.327 -2.772 1.00 0.00 N HETATM 38 C UNL 1 8.520 3.400 -3.893 1.00 0.00 C HETATM 39 C UNL 1 8.642 4.469 -5.486 1.00 0.00 C HETATM 40 N UNL 1 8.099 5.991 -5.653 1.00 0.00 N HETATM 41 C UNL 1 6.751 6.195 -5.036 1.00 0.00 C HETATM 42 C UNL 1 7.014 5.394 -3.848 1.00 0.00 C HETATM 43 C UNL 1 6.329 4.531 -2.908 1.00 0.00 C HETATM 44 C UNL 1 8.008 6.621 -6.980 1.00 0.00 C HETATM 45 H UNL 1 -2.465 -4.245 4.017 1.00 0.00 H HETATM 46 H UNL 1 -2.967 0.040 1.407 1.00 0.00 H HETATM 47 H UNL 1 -0.061 -0.058 1.615 1.00 0.00 H HETATM 48 H UNL 1 0.384 -4.401 3.135 1.00 0.00 H HETATM 49 H UNL 1 0.696 -3.351 4.538 1.00 0.00 H HETATM 50 H UNL 1 2.344 -3.611 1.983 1.00 0.00 H HETATM 51 H UNL 1 2.804 -4.147 3.611 1.00 0.00 H HETATM 52 H UNL 1 2.679 -2.419 3.250 1.00 0.00 H HETATM 53 H UNL 1 -4.376 -1.715 3.590 1.00 0.00 H HETATM 54 H UNL 1 -6.150 -5.399 5.434 1.00 0.00 H HETATM 55 H UNL 1 -7.744 -2.186 4.245 1.00 0.00 H HETATM 56 H UNL 1 -10.572 -6.331 8.789 1.00 0.00 H HETATM 57 H UNL 1 -11.180 -4.759 8.721 1.00 0.00 H HETATM 58 H UNL 1 -9.709 -4.849 9.427 1.00 0.00 H HETATM 59 H UNL 1 -10.395 -1.271 6.533 1.00 0.00 H HETATM 60 H UNL 1 -10.710 -1.160 4.748 1.00 0.00 H HETATM 61 H UNL 1 -9.148 -0.750 5.529 1.00 0.00 H HETATM 62 H UNL 1 -13.111 -6.115 7.553 1.00 0.00 H HETATM 63 H UNL 1 -14.274 -3.980 8.258 1.00 0.00 H HETATM 64 H UNL 1 -13.225 -1.852 7.471 1.00 0.00 H HETATM 65 H UNL 1 -11.153 -2.794 7.012 1.00 0.00 H HETATM 66 H UNL 1 5.802 -0.670 0.488 1.00 0.00 H HETATM 67 H UNL 1 5.717 0.865 1.345 1.00 0.00 H HETATM 68 H UNL 1 7.324 0.353 -1.281 1.00 0.00 H HETATM 69 H UNL 1 7.695 1.413 0.059 1.00 0.00 H HETATM 70 H UNL 1 6.658 3.229 -0.766 1.00 0.00 H HETATM 71 H UNL 1 4.905 1.369 -2.454 1.00 0.00 H HETATM 72 H UNL 1 4.541 3.077 -2.258 1.00 0.00 H HETATM 73 H UNL 1 3.107 2.487 -0.552 1.00 0.00 H HETATM 74 H UNL 1 4.611 2.578 0.320 1.00 0.00 H HETATM 75 H UNL 1 8.706 2.384 -4.261 1.00 0.00 H HETATM 76 H UNL 1 9.414 3.747 -3.347 1.00 0.00 H HETATM 77 H UNL 1 8.125 3.891 -6.266 1.00 0.00 H HETATM 78 H UNL 1 9.706 4.516 -5.770 1.00 0.00 H HETATM 79 H UNL 1 5.956 5.772 -5.671 1.00 0.00 H HETATM 80 H UNL 1 6.519 7.234 -4.798 1.00 0.00 H HETATM 81 H UNL 1 7.985 5.689 -3.414 1.00 0.00 H HETATM 82 H UNL 1 6.954 4.534 -4.521 1.00 0.00 H HETATM 83 H UNL 1 5.414 4.208 -3.399 1.00 0.00 H HETATM 84 H UNL 1 6.142 5.055 -1.973 1.00 0.00 H HETATM 85 H UNL 1 8.966 6.779 -7.480 1.00 0.00 H HETATM 86 H UNL 1 7.596 7.644 -6.856 1.00 0.00 H HETATM 87 H UNL 1 7.307 6.116 -7.656 1.00 0.00 H CONECT 1 2 6 25 CONECT 2 1 3 45 CONECT 3 2 4 7 CONECT 4 3 5 10 CONECT 5 4 6 46 CONECT 6 5 1 47 CONECT 7 3 8 CONECT 8 7 9 48 49 CONECT 9 8 50 51 52 CONECT 10 4 11 53 CONECT 11 10 12 16 CONECT 12 11 13 54 CONECT 13 12 14 17 CONECT 14 13 15 21 CONECT 15 14 16 55 CONECT 16 15 11 CONECT 17 13 18 23 CONECT 18 17 19 28 CONECT 19 18 20 31 CONECT 20 19 21 22 CONECT 21 20 14 24 CONECT 22 20 CONECT 23 17 56 57 58 CONECT 24 21 59 60 61 CONECT 25 1 26 27 CONECT 26 25 CONECT 27 25 32 36 CONECT 28 18 29 62 CONECT 29 28 30 63 CONECT 30 29 31 64 CONECT 31 30 19 65 CONECT 32 27 33 66 67 CONECT 33 32 34 68 69 CONECT 34 33 35 37 70 CONECT 35 34 36 71 72 CONECT 36 35 27 73 74 CONECT 37 34 38 43 CONECT 38 37 39 75 76 CONECT 39 38 40 77 78 CONECT 40 39 41 44 CONECT 41 40 42 79 80 CONECT 42 41 43 81 82 CONECT 43 42 37 83 84 CONECT 44 40 85 86 87 CONECT 45 2 CONECT 46 5 CONECT 47 6 CONECT 48 8 CONECT 49 8 CONECT 50 9 CONECT 51 9 CONECT 52 9 CONECT 53 10 CONECT 54 12 CONECT 55 15 CONECT 56 23 CONECT 57 23 CONECT 58 23 CONECT 59 24 CONECT 60 24 CONECT 61 24 CONECT 62 28 CONECT 63 29 CONECT 64 30 CONECT 65 31 CONECT 66 32 CONECT 67 32 CONECT 68 33 CONECT 69 33 CONECT 70 34 CONECT 71 35 CONECT 72 35 CONECT 73 36 CONECT 74 36 CONECT 75 38 CONECT 76 38 CONECT 77 39 CONECT 78 39 CONECT 79 41 CONECT 80 41 CONECT 81 42 CONECT 82 42 CONECT 83 43 CONECT 84 43 CONECT 85 44 CONECT 86 44 CONECT 87 44 MASTER 0 0 0 0 0 0 0 0 87 0 87 0 END M END $$$$