D0I9PC AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -7.123 -4.244 2.555 1.00 0.00 C HETATM 2 C UNL 1 -6.924 -4.625 1.203 1.00 0.00 C HETATM 3 C UNL 1 -6.105 -3.562 3.181 1.00 0.00 C HETATM 4 C UNL 1 -4.856 -4.061 2.918 1.00 0.00 C HETATM 5 C UNL 1 -4.576 -4.365 1.567 1.00 0.00 C HETATM 6 C UNL 1 -5.641 -4.517 0.636 1.00 0.00 C HETATM 7 O UNL 1 -5.301 -4.583 -0.705 1.00 0.00 O HETATM 8 C UNL 1 -6.067 -5.283 -1.753 1.00 0.00 C HETATM 9 C UNL 1 -6.048 -4.522 -3.142 1.00 0.00 C HETATM 10 C UNL 1 -6.540 -5.091 -4.568 1.00 0.00 C HETATM 11 C UNL 1 -7.949 -5.569 -5.125 1.00 0.00 C HETATM 12 C UNL 1 -9.238 -5.027 -5.034 1.00 0.00 C HETATM 13 N UNL 1 -10.008 -5.583 -6.043 1.00 0.00 N HETATM 14 C UNL 1 -9.536 -6.807 -6.440 1.00 0.00 C HETATM 15 C UNL 1 -8.190 -6.766 -6.008 1.00 0.00 C HETATM 16 C UNL 1 -10.209 -7.895 -7.136 1.00 0.00 C HETATM 17 C UNL 1 -9.353 -8.977 -7.378 1.00 0.00 C HETATM 18 C UNL 1 -8.005 -8.975 -6.990 1.00 0.00 C HETATM 19 C UNL 1 -7.392 -7.861 -6.389 1.00 0.00 C HETATM 20 C UNL 1 -9.929 -4.124 -4.156 1.00 0.00 C HETATM 21 N UNL 1 -9.106 -3.463 -3.279 1.00 0.00 N HETATM 22 C UNL 1 -4.223 -4.771 4.100 1.00 0.00 C HETATM 23 CL UNL 1 -6.257 -1.827 3.260 1.00 0.00 Cl HETATM 24 C UNL 1 -8.094 -4.868 3.524 1.00 0.00 C HETATM 25 C UNL 1 -11.718 -7.956 -7.382 1.00 0.00 C HETATM 26 C UNL 1 -12.555 -7.277 -6.472 1.00 0.00 C HETATM 27 C UNL 1 -13.943 -7.198 -6.590 1.00 0.00 C HETATM 28 C UNL 1 -14.541 -7.852 -7.631 1.00 0.00 C HETATM 29 N UNL 1 -13.836 -8.598 -8.488 1.00 0.00 N HETATM 30 C UNL 1 -12.466 -8.688 -8.351 1.00 0.00 C HETATM 31 C UNL 1 -11.954 -9.729 -9.305 1.00 0.00 C HETATM 32 S UNL 1 -9.495 -3.276 -1.692 1.00 0.00 S HETATM 33 C UNL 1 -10.665 -1.975 -1.753 1.00 0.00 C HETATM 34 C UNL 1 -11.928 -2.137 -1.185 1.00 0.00 C HETATM 35 C UNL 1 -12.651 -0.996 -0.889 1.00 0.00 C HETATM 36 C UNL 1 -12.112 0.238 -1.236 1.00 0.00 C HETATM 37 C UNL 1 -11.103 0.319 -2.188 1.00 0.00 C HETATM 38 C UNL 1 -10.267 -0.767 -2.322 1.00 0.00 C HETATM 39 O UNL 1 -11.148 -4.001 -4.153 1.00 0.00 O HETATM 40 O UNL 1 -10.094 -4.486 -1.247 1.00 0.00 O HETATM 41 O UNL 1 -8.291 -2.749 -1.060 1.00 0.00 O HETATM 42 H UNL 1 -7.758 -5.024 0.640 1.00 0.00 H HETATM 43 H UNL 1 -3.556 -4.584 1.252 1.00 0.00 H HETATM 44 H UNL 1 -7.086 -5.483 -1.432 1.00 0.00 H HETATM 45 H UNL 1 -5.525 -6.223 -1.891 1.00 0.00 H HETATM 46 H UNL 1 -4.976 -4.310 -3.315 1.00 0.00 H HETATM 47 H UNL 1 -6.416 -3.504 -2.982 1.00 0.00 H HETATM 48 H UNL 1 -5.795 -5.831 -4.891 1.00 0.00 H HETATM 49 H UNL 1 -6.343 -4.230 -5.236 1.00 0.00 H HETATM 50 H UNL 1 -10.940 -5.250 -6.249 1.00 0.00 H HETATM 51 H UNL 1 -9.735 -9.891 -7.821 1.00 0.00 H HETATM 52 H UNL 1 -7.439 -9.900 -7.086 1.00 0.00 H HETATM 53 H UNL 1 -6.340 -7.909 -6.127 1.00 0.00 H HETATM 54 H UNL 1 -8.133 -3.339 -3.492 1.00 0.00 H HETATM 55 H UNL 1 -4.827 -4.616 5.013 1.00 0.00 H HETATM 56 H UNL 1 -3.211 -4.440 4.327 1.00 0.00 H HETATM 57 H UNL 1 -4.249 -5.854 3.930 1.00 0.00 H HETATM 58 H UNL 1 -9.135 -4.680 3.274 1.00 0.00 H HETATM 59 H UNL 1 -7.925 -4.480 4.546 1.00 0.00 H HETATM 60 H UNL 1 -7.889 -5.943 3.599 1.00 0.00 H HETATM 61 H UNL 1 -12.134 -6.824 -5.576 1.00 0.00 H HETATM 62 H UNL 1 -14.532 -6.651 -5.864 1.00 0.00 H HETATM 63 H UNL 1 -15.616 -7.828 -7.788 1.00 0.00 H HETATM 64 H UNL 1 -12.807 -10.211 -9.814 1.00 0.00 H HETATM 65 H UNL 1 -11.461 -10.549 -8.779 1.00 0.00 H HETATM 66 H UNL 1 -11.325 -9.307 -10.088 1.00 0.00 H HETATM 67 H UNL 1 -12.294 -3.112 -0.876 1.00 0.00 H HETATM 68 H UNL 1 -13.574 -1.052 -0.318 1.00 0.00 H HETATM 69 H UNL 1 -12.353 1.110 -0.633 1.00 0.00 H HETATM 70 H UNL 1 -10.947 1.217 -2.776 1.00 0.00 H HETATM 71 H UNL 1 -9.311 -0.665 -2.830 1.00 0.00 H CONECT 1 2 3 24 CONECT 2 1 6 42 CONECT 3 1 4 23 CONECT 4 3 5 22 CONECT 5 4 6 43 CONECT 6 5 2 7 CONECT 7 6 8 CONECT 8 7 9 44 45 CONECT 9 8 10 46 47 CONECT 10 9 11 48 49 CONECT 11 10 12 15 CONECT 12 11 13 20 CONECT 13 12 14 50 CONECT 14 13 15 16 CONECT 15 14 11 19 CONECT 16 14 17 25 CONECT 17 16 18 51 CONECT 18 17 19 52 CONECT 19 18 15 53 CONECT 20 12 21 39 CONECT 21 20 32 54 CONECT 22 4 55 56 57 CONECT 23 3 CONECT 24 1 58 59 60 CONECT 25 16 26 30 CONECT 26 25 27 61 CONECT 27 26 28 62 CONECT 28 27 29 63 CONECT 29 28 30 CONECT 30 29 25 31 CONECT 31 30 64 65 66 CONECT 32 21 33 40 41 CONECT 33 32 34 38 CONECT 34 33 35 67 CONECT 35 34 36 68 CONECT 36 35 37 69 CONECT 37 36 38 70 CONECT 38 37 33 71 CONECT 39 20 CONECT 40 32 CONECT 41 32 CONECT 42 2 CONECT 43 5 CONECT 44 8 CONECT 45 8 CONECT 46 9 CONECT 47 9 CONECT 48 10 CONECT 49 10 CONECT 50 13 CONECT 51 17 CONECT 52 18 CONECT 53 19 CONECT 54 21 CONECT 55 22 CONECT 56 22 CONECT 57 22 CONECT 58 24 CONECT 59 24 CONECT 60 24 CONECT 61 26 CONECT 62 27 CONECT 63 28 CONECT 64 31 CONECT 65 31 CONECT 66 31 CONECT 67 34 CONECT 68 35 CONECT 69 36 CONECT 70 37 CONECT 71 38 MASTER 0 0 0 0 0 0 0 0 71 0 71 0 END M END $$$$