D0RG4J AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.822 4.096 2.357 1.00 0.00 C HETATM 2 C UNL 1 1.721 4.109 3.217 1.00 0.00 C HETATM 3 C UNL 1 0.430 4.031 2.696 1.00 0.00 C HETATM 4 C UNL 1 0.279 3.812 1.326 1.00 0.00 C HETATM 5 C UNL 1 1.313 4.265 0.513 1.00 0.00 C HETATM 6 C UNL 1 2.619 4.254 0.990 1.00 0.00 C HETATM 7 CL UNL 1 0.952 5.242 -0.865 1.00 0.00 Cl HETATM 8 C UNL 1 -0.164 2.378 1.095 1.00 0.00 C HETATM 9 N UNL 1 0.339 1.703 -0.010 1.00 0.00 N HETATM 10 O UNL 1 -0.845 1.797 1.946 1.00 0.00 O HETATM 11 C UNL 1 0.557 0.248 -0.027 1.00 0.00 C HETATM 12 C UNL 1 -0.664 -0.704 0.126 1.00 0.00 C HETATM 13 C UNL 1 -1.693 -0.480 -0.993 1.00 0.00 C HETATM 14 C UNL 1 -2.217 0.787 -1.248 1.00 0.00 C HETATM 15 N UNL 1 -3.035 1.119 -2.279 1.00 0.00 N HETATM 16 C UNL 1 -3.433 0.126 -3.106 1.00 0.00 C HETATM 17 C UNL 1 -3.041 -1.197 -2.877 1.00 0.00 C HETATM 18 C UNL 1 -2.179 -1.495 -1.816 1.00 0.00 C HETATM 19 C UNL 1 -0.156 -2.208 0.223 1.00 0.00 C HETATM 20 C UNL 1 0.859 -2.519 1.320 1.00 0.00 C HETATM 21 C UNL 1 0.378 -2.142 2.727 1.00 0.00 C HETATM 22 C UNL 1 0.602 -3.578 2.408 1.00 0.00 C HETATM 23 C UNL 1 -4.274 0.429 -4.332 1.00 0.00 C HETATM 24 F UNL 1 -4.833 1.671 -4.349 1.00 0.00 F HETATM 25 F UNL 1 -3.558 0.331 -5.497 1.00 0.00 F HETATM 26 F UNL 1 -5.315 -0.445 -4.483 1.00 0.00 F HETATM 27 C UNL 1 2.315 -2.532 0.886 1.00 0.00 C HETATM 28 F UNL 1 2.454 -2.240 -0.428 1.00 0.00 F HETATM 29 F UNL 1 3.049 -1.641 1.586 1.00 0.00 F HETATM 30 F UNL 1 2.886 -3.748 1.073 1.00 0.00 F HETATM 31 H UNL 1 3.828 4.050 2.761 1.00 0.00 H HETATM 32 H UNL 1 1.864 4.124 4.295 1.00 0.00 H HETATM 33 H UNL 1 -0.418 3.896 3.364 1.00 0.00 H HETATM 34 H UNL 1 3.459 4.439 0.327 1.00 0.00 H HETATM 35 H UNL 1 0.892 2.229 -0.676 1.00 0.00 H HETATM 36 H UNL 1 1.280 0.072 0.773 1.00 0.00 H HETATM 37 H UNL 1 1.070 0.051 -0.980 1.00 0.00 H HETATM 38 H UNL 1 -1.181 -0.477 1.065 1.00 0.00 H HETATM 39 H UNL 1 -2.001 1.632 -0.606 1.00 0.00 H HETATM 40 H UNL 1 -3.396 -1.991 -3.525 1.00 0.00 H HETATM 41 H UNL 1 -1.913 -2.533 -1.668 1.00 0.00 H HETATM 42 H UNL 1 0.257 -2.502 -0.751 1.00 0.00 H HETATM 43 H UNL 1 -1.028 -2.852 0.381 1.00 0.00 H HETATM 44 H UNL 1 -0.661 -1.863 2.887 1.00 0.00 H HETATM 45 H UNL 1 1.065 -1.620 3.380 1.00 0.00 H HETATM 46 H UNL 1 -0.241 -4.247 2.275 1.00 0.00 H HETATM 47 H UNL 1 1.434 -4.044 2.925 1.00 0.00 H CONECT 1 2 6 31 CONECT 2 1 3 32 CONECT 3 2 4 33 CONECT 4 3 5 8 CONECT 5 4 6 7 CONECT 6 5 1 34 CONECT 7 5 CONECT 8 4 9 10 CONECT 9 8 11 35 CONECT 10 8 CONECT 11 9 12 36 37 CONECT 12 11 13 19 38 CONECT 13 12 14 18 CONECT 14 13 15 39 CONECT 15 14 16 CONECT 16 15 17 23 CONECT 17 16 18 40 CONECT 18 17 13 41 CONECT 19 12 20 42 43 CONECT 20 19 21 22 27 CONECT 21 20 22 44 45 CONECT 22 21 20 46 47 CONECT 23 16 24 25 26 CONECT 24 23 CONECT 25 23 CONECT 26 23 CONECT 27 20 28 29 30 CONECT 28 27 CONECT 29 27 CONECT 30 27 CONECT 31 1 CONECT 32 2 CONECT 33 3 CONECT 34 6 CONECT 35 9 CONECT 36 11 CONECT 37 11 CONECT 38 12 CONECT 39 14 CONECT 40 17 CONECT 41 18 CONECT 42 19 CONECT 43 19 CONECT 44 21 CONECT 45 21 CONECT 46 22 CONECT 47 22 MASTER 0 0 0 0 0 0 0 0 47 0 47 0 END M END $$$$