D00PJE AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -0.021 -3.051 2.057 1.00 0.00 C HETATM 2 C UNL 1 -1.402 -3.298 1.743 1.00 0.00 C HETATM 3 C UNL 1 -2.406 -2.267 1.590 1.00 0.00 C HETATM 4 C UNL 1 -1.608 -0.886 1.535 1.00 0.00 C HETATM 5 C UNL 1 -0.030 -0.636 1.862 1.00 0.00 C HETATM 6 C UNL 1 0.672 -1.782 2.138 1.00 0.00 C HETATM 7 C UNL 1 -4.246 -2.672 1.057 1.00 0.00 C HETATM 8 N UNL 1 -5.521 -4.003 1.220 1.00 0.00 N HETATM 9 C UNL 1 -7.174 -4.576 1.105 1.00 0.00 C HETATM 10 C UNL 1 -7.009 -5.916 0.995 1.00 0.00 C HETATM 11 C UNL 1 -5.700 -6.289 1.296 1.00 0.00 C HETATM 12 C UNL 1 -4.849 -5.217 1.406 1.00 0.00 C HETATM 13 C UNL 1 -5.230 -7.536 1.865 1.00 0.00 C HETATM 14 C UNL 1 -4.447 -7.209 2.953 1.00 0.00 C HETATM 15 C UNL 1 -3.378 -6.502 2.469 1.00 0.00 C HETATM 16 N UNL 1 -3.573 -5.349 1.791 1.00 0.00 N HETATM 17 C UNL 1 -9.073 -4.418 1.152 1.00 0.00 C HETATM 18 N UNL 1 -10.239 -5.919 1.289 1.00 0.00 N HETATM 19 C UNL 1 -9.499 -7.070 0.950 1.00 0.00 C HETATM 20 C UNL 1 -8.028 -6.949 0.990 1.00 0.00 C HETATM 21 C UNL 1 -11.702 -6.588 1.405 1.00 0.00 C HETATM 22 C UNL 1 -13.314 -6.194 2.031 1.00 0.00 C HETATM 23 O UNL 1 -11.818 -7.793 0.978 1.00 0.00 O HETATM 24 C UNL 1 1.106 0.588 2.005 1.00 0.00 C HETATM 25 C UNL 1 1.372 2.126 1.822 1.00 0.00 C HETATM 26 C UNL 1 -14.868 -7.169 2.295 1.00 0.00 C HETATM 27 C UNL 1 -14.932 -8.050 3.624 1.00 0.00 C HETATM 28 C UNL 1 -16.423 -8.265 3.909 1.00 0.00 C HETATM 29 C UNL 1 -17.034 -8.222 2.496 1.00 0.00 C HETATM 30 C UNL 1 -17.451 -6.770 2.327 1.00 0.00 C HETATM 31 C UNL 1 -16.060 -6.066 2.245 1.00 0.00 C HETATM 32 C UNL 1 -15.752 -8.239 1.481 1.00 0.00 C HETATM 33 C UNL 1 -18.166 -9.270 2.362 1.00 0.00 C HETATM 34 O UNL 1 -18.494 -10.056 3.236 1.00 0.00 O HETATM 35 O UNL 1 -18.776 -9.272 1.153 1.00 0.00 O HETATM 36 H UNL 1 0.654 -3.885 2.222 1.00 0.00 H HETATM 37 H UNL 1 -1.644 -4.316 1.697 1.00 0.00 H HETATM 38 H UNL 1 -2.118 0.021 1.263 1.00 0.00 H HETATM 39 H UNL 1 1.784 -1.786 2.385 1.00 0.00 H HETATM 40 H UNL 1 -4.088 -2.856 -0.020 1.00 0.00 H HETATM 41 H UNL 1 -4.870 -1.812 1.273 1.00 0.00 H HETATM 42 H UNL 1 -5.918 -8.385 1.942 1.00 0.00 H HETATM 43 H UNL 1 -5.047 -6.577 3.666 1.00 0.00 H HETATM 44 H UNL 1 -2.463 -7.030 2.255 1.00 0.00 H HETATM 45 H UNL 1 -9.328 -4.093 0.134 1.00 0.00 H HETATM 46 H UNL 1 -9.378 -3.723 1.928 1.00 0.00 H HETATM 47 H UNL 1 -9.834 -7.474 -0.026 1.00 0.00 H HETATM 48 H UNL 1 -9.759 -7.896 1.665 1.00 0.00 H HETATM 49 H UNL 1 -7.903 -7.100 2.084 1.00 0.00 H HETATM 50 H UNL 1 -7.766 -7.279 -0.013 1.00 0.00 H HETATM 51 H UNL 1 -13.658 -5.392 1.372 1.00 0.00 H HETATM 52 H UNL 1 -13.137 -5.801 3.039 1.00 0.00 H HETATM 53 H UNL 1 1.964 0.209 1.404 1.00 0.00 H HETATM 54 H UNL 1 1.481 0.463 3.044 1.00 0.00 H HETATM 55 H UNL 1 1.379 2.471 0.783 1.00 0.00 H HETATM 56 H UNL 1 2.417 2.352 2.158 1.00 0.00 H HETATM 57 H UNL 1 0.761 2.779 2.447 1.00 0.00 H HETATM 58 H UNL 1 -14.417 -7.666 4.496 1.00 0.00 H HETATM 59 H UNL 1 -14.542 -9.068 3.432 1.00 0.00 H HETATM 60 H UNL 1 -16.808 -7.440 4.534 1.00 0.00 H HETATM 61 H UNL 1 -16.669 -9.172 4.475 1.00 0.00 H HETATM 62 H UNL 1 -18.063 -6.407 3.166 1.00 0.00 H HETATM 63 H UNL 1 -18.068 -6.602 1.430 1.00 0.00 H HETATM 64 H UNL 1 -15.962 -5.315 3.031 1.00 0.00 H HETATM 65 H UNL 1 -16.030 -5.572 1.267 1.00 0.00 H HETATM 66 H UNL 1 -15.354 -9.258 1.406 1.00 0.00 H HETATM 67 H UNL 1 -16.057 -7.913 0.477 1.00 0.00 H HETATM 68 H UNL 1 -18.411 -8.630 0.516 1.00 0.00 H CONECT 1 2 6 36 CONECT 2 1 3 37 CONECT 3 2 4 7 CONECT 4 3 5 38 CONECT 5 4 6 24 CONECT 6 5 1 39 CONECT 7 3 8 40 41 CONECT 8 7 9 12 CONECT 9 8 10 17 CONECT 10 9 11 20 CONECT 11 10 12 13 CONECT 12 11 8 16 CONECT 13 11 14 42 CONECT 14 13 15 43 CONECT 15 14 16 44 CONECT 16 15 12 CONECT 17 9 18 45 46 CONECT 18 17 19 21 CONECT 19 18 20 47 48 CONECT 20 19 10 49 50 CONECT 21 18 22 23 CONECT 22 21 26 51 52 CONECT 23 21 CONECT 24 5 25 53 54 CONECT 25 24 55 56 57 CONECT 26 22 27 31 32 CONECT 27 26 28 58 59 CONECT 28 27 29 60 61 CONECT 29 28 30 32 33 CONECT 30 29 31 62 63 CONECT 31 30 26 64 65 CONECT 32 26 29 66 67 CONECT 33 29 34 35 CONECT 34 33 CONECT 35 33 68 CONECT 36 1 CONECT 37 2 CONECT 38 4 CONECT 39 6 CONECT 40 7 CONECT 41 7 CONECT 42 13 CONECT 43 14 CONECT 44 15 CONECT 45 17 CONECT 46 17 CONECT 47 19 CONECT 48 19 CONECT 49 20 CONECT 50 20 CONECT 51 22 CONECT 52 22 CONECT 53 24 CONECT 54 24 CONECT 55 25 CONECT 56 25 CONECT 57 25 CONECT 58 27 CONECT 59 27 CONECT 60 28 CONECT 61 28 CONECT 62 30 CONECT 63 30 CONECT 64 31 CONECT 65 31 CONECT 66 32 CONECT 67 32 CONECT 68 35 MASTER 0 0 0 0 0 0 0 0 68 0 68 0 END M END $$$$