D0AE6Y AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.969 1.084 2.200 1.00 0.00 C HETATM 2 C UNL 1 2.301 1.244 0.966 1.00 0.00 C HETATM 3 C UNL 1 1.019 0.500 0.832 1.00 0.00 C HETATM 4 N UNL 1 1.226 -0.776 0.800 1.00 0.00 N HETATM 5 C UNL 1 1.085 -1.431 2.130 1.00 0.00 C HETATM 6 C UNL 1 1.529 -0.606 3.322 1.00 0.00 C HETATM 7 N UNL 1 2.273 0.562 3.312 1.00 0.00 N HETATM 8 C UNL 1 4.364 0.926 2.252 1.00 0.00 C HETATM 9 C UNL 1 5.068 0.730 1.062 1.00 0.00 C HETATM 10 C UNL 1 4.421 0.878 -0.166 1.00 0.00 C HETATM 11 C UNL 1 3.073 1.269 -0.211 1.00 0.00 C HETATM 12 C UNL 1 -0.388 1.001 0.897 1.00 0.00 C HETATM 13 C UNL 1 -0.818 2.185 1.498 1.00 0.00 C HETATM 14 C UNL 1 -2.202 2.399 1.687 1.00 0.00 C HETATM 15 C UNL 1 -3.140 1.445 1.280 1.00 0.00 C HETATM 16 C UNL 1 -2.724 0.289 0.638 1.00 0.00 C HETATM 17 C UNL 1 -1.361 0.085 0.433 1.00 0.00 C HETATM 18 CL UNL 1 -4.818 1.675 1.588 1.00 0.00 Cl HETATM 19 O UNL 1 4.988 0.577 -1.380 1.00 0.00 O HETATM 20 C UNL 1 6.012 -0.423 -1.370 1.00 0.00 C HETATM 21 N UNL 1 1.218 -0.888 4.576 1.00 0.00 N HETATM 22 N UNL 1 1.726 0.085 5.385 1.00 0.00 N HETATM 23 C UNL 1 2.330 0.978 4.631 1.00 0.00 C HETATM 24 C UNL 1 2.871 2.267 5.128 1.00 0.00 C HETATM 25 C UNL 1 1.755 -2.823 2.006 1.00 0.00 C HETATM 26 C UNL 1 1.741 -3.580 3.322 1.00 0.00 C HETATM 27 O UNL 1 2.733 -4.085 3.862 1.00 0.00 O HETATM 28 O UNL 1 0.450 -3.684 3.788 1.00 0.00 O HETATM 29 C UNL 1 0.371 -4.271 5.089 1.00 0.00 C HETATM 30 H UNL 1 0.014 -1.604 2.282 1.00 0.00 H HETATM 31 C UNL 1 3.172 -2.811 1.432 1.00 0.00 C HETATM 32 H UNL 1 4.874 0.711 3.192 1.00 0.00 H HETATM 33 H UNL 1 6.093 0.375 1.122 1.00 0.00 H HETATM 34 H UNL 1 2.588 1.341 -1.181 1.00 0.00 H HETATM 35 H UNL 1 -0.120 2.925 1.872 1.00 0.00 H HETATM 36 H UNL 1 -2.551 3.302 2.184 1.00 0.00 H HETATM 37 H UNL 1 -3.434 -0.470 0.322 1.00 0.00 H HETATM 38 H UNL 1 -1.050 -0.838 -0.054 1.00 0.00 H HETATM 39 H UNL 1 6.124 -0.803 -2.392 1.00 0.00 H HETATM 40 H UNL 1 5.762 -1.282 -0.733 1.00 0.00 H HETATM 41 H UNL 1 6.968 0.016 -1.071 1.00 0.00 H HETATM 42 H UNL 1 2.304 2.578 6.015 1.00 0.00 H HETATM 43 H UNL 1 2.779 3.070 4.392 1.00 0.00 H HETATM 44 H UNL 1 3.918 2.166 5.426 1.00 0.00 H HETATM 45 H UNL 1 1.150 -3.411 1.300 1.00 0.00 H HETATM 46 H UNL 1 -0.588 -3.987 5.529 1.00 0.00 H HETATM 47 H UNL 1 1.166 -3.910 5.751 1.00 0.00 H HETATM 48 H UNL 1 0.413 -5.359 4.999 1.00 0.00 H HETATM 49 H UNL 1 3.878 -2.294 2.087 1.00 0.00 H HETATM 50 H UNL 1 3.212 -2.350 0.439 1.00 0.00 H HETATM 51 H UNL 1 3.533 -3.842 1.312 1.00 0.00 H CONECT 1 2 7 8 CONECT 2 1 3 11 CONECT 3 2 4 12 CONECT 4 3 5 CONECT 5 4 6 30 25 CONECT 6 5 7 21 CONECT 7 6 1 23 CONECT 8 1 9 32 CONECT 9 8 10 33 CONECT 10 9 11 19 CONECT 11 10 2 34 CONECT 12 3 13 17 CONECT 13 12 14 35 CONECT 14 13 15 36 CONECT 15 14 16 18 CONECT 16 15 17 37 CONECT 17 16 12 38 CONECT 18 15 CONECT 19 10 20 CONECT 20 19 39 40 41 CONECT 21 6 22 CONECT 22 21 23 CONECT 23 22 7 24 CONECT 24 23 42 43 44 CONECT 25 31 26 5 45 CONECT 26 27 28 25 CONECT 27 26 CONECT 28 26 29 CONECT 29 28 46 47 48 CONECT 30 5 CONECT 31 25 49 50 51 CONECT 32 8 CONECT 33 9 CONECT 34 11 CONECT 35 13 CONECT 36 14 CONECT 37 16 CONECT 38 17 CONECT 39 20 CONECT 40 20 CONECT 41 20 CONECT 42 24 CONECT 43 24 CONECT 44 24 CONECT 45 25 CONECT 46 29 CONECT 47 29 CONECT 48 29 CONECT 49 31 CONECT 50 31 CONECT 51 31 MASTER 0 0 0 0 0 0 0 0 51 0 51 0 END M END $$$$