D0B6NT AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -1.692 -1.877 0.924 1.00 0.00 C HETATM 2 C UNL 1 -2.566 -2.909 1.386 1.00 0.00 C HETATM 3 C UNL 1 -1.835 -4.228 0.966 1.00 0.00 C HETATM 4 N UNL 1 -1.236 -4.443 -0.165 1.00 0.00 N HETATM 5 C UNL 1 -1.136 -3.347 -0.967 1.00 0.00 C HETATM 6 N UNL 1 -1.331 -2.051 -0.428 1.00 0.00 N HETATM 7 C UNL 1 -0.503 -0.845 1.574 1.00 0.00 C HETATM 8 C UNL 1 -4.095 -3.463 0.874 1.00 0.00 C HETATM 9 C UNL 1 0.899 -1.019 1.300 1.00 0.00 C HETATM 10 C UNL 1 1.865 0.063 1.240 1.00 0.00 C HETATM 11 C UNL 1 1.458 1.384 1.331 1.00 0.00 C HETATM 12 C UNL 1 0.139 1.612 1.671 1.00 0.00 C HETATM 13 C UNL 1 -0.764 0.509 1.912 1.00 0.00 C HETATM 14 C UNL 1 -4.615 -3.269 -0.429 1.00 0.00 C HETATM 15 C UNL 1 -5.706 -4.032 -0.986 1.00 0.00 C HETATM 16 C UNL 1 -6.344 -5.048 -0.283 1.00 0.00 C HETATM 17 C UNL 1 -5.908 -5.250 1.019 1.00 0.00 C HETATM 18 C UNL 1 -4.823 -4.483 1.584 1.00 0.00 C HETATM 19 CL UNL 1 2.576 2.693 1.168 1.00 0.00 Cl HETATM 20 CL UNL 1 -4.412 -4.919 3.213 1.00 0.00 Cl HETATM 21 C UNL 1 -0.428 -3.050 -2.134 1.00 0.00 C HETATM 22 C UNL 1 -1.067 -1.814 -2.449 1.00 0.00 C HETATM 23 N UNL 1 -0.881 -1.115 -1.324 1.00 0.00 N HETATM 24 C UNL 1 0.938 -3.580 -2.242 1.00 0.00 C HETATM 25 O UNL 1 1.244 -4.653 -1.726 1.00 0.00 O HETATM 26 N UNL 1 1.914 -2.792 -2.846 1.00 0.00 N HETATM 27 S UNL 1 5.250 -1.455 -2.168 1.00 0.00 S HETATM 28 O UNL 1 6.545 -2.087 -2.202 1.00 0.00 O HETATM 29 O UNL 1 5.051 -0.006 -2.071 1.00 0.00 O HETATM 30 C UNL 1 4.244 -2.095 -3.520 1.00 0.00 C HETATM 31 C UNL 1 3.343 -3.235 -2.942 1.00 0.00 C HETATM 32 C UNL 1 3.951 -3.574 -1.545 1.00 0.00 C HETATM 33 C UNL 1 4.280 -2.243 -0.902 1.00 0.00 C HETATM 34 C UNL 1 3.424 -4.489 -3.832 1.00 0.00 C HETATM 35 O UNL 1 -2.386 -1.747 -2.871 1.00 0.00 O HETATM 36 C UNL 1 -2.935 -0.411 -2.912 1.00 0.00 C HETATM 37 C UNL 1 -4.475 -0.434 -2.907 1.00 0.00 C HETATM 38 O UNL 1 -4.997 -1.440 -3.766 1.00 0.00 O HETATM 39 H UNL 1 -2.042 -5.100 1.610 1.00 0.00 H HETATM 40 H UNL 1 1.309 -2.005 1.091 1.00 0.00 H HETATM 41 H UNL 1 2.929 -0.126 1.086 1.00 0.00 H HETATM 42 H UNL 1 -0.177 2.644 1.838 1.00 0.00 H HETATM 43 H UNL 1 -1.504 0.727 2.679 1.00 0.00 H HETATM 44 H UNL 1 -4.156 -2.559 -1.101 1.00 0.00 H HETATM 45 H UNL 1 -6.037 -3.860 -2.015 1.00 0.00 H HETATM 46 H UNL 1 -7.139 -5.661 -0.729 1.00 0.00 H HETATM 47 H UNL 1 -6.384 -6.057 1.585 1.00 0.00 H HETATM 48 H UNL 1 1.577 -2.054 -3.454 1.00 0.00 H HETATM 49 H UNL 1 4.936 -2.435 -4.293 1.00 0.00 H HETATM 50 H UNL 1 3.652 -1.262 -3.905 1.00 0.00 H HETATM 51 H UNL 1 4.882 -4.142 -1.684 1.00 0.00 H HETATM 52 H UNL 1 3.320 -4.177 -0.893 1.00 0.00 H HETATM 53 H UNL 1 4.844 -2.319 0.030 1.00 0.00 H HETATM 54 H UNL 1 3.379 -1.639 -0.750 1.00 0.00 H HETATM 55 H UNL 1 4.427 -4.630 -4.248 1.00 0.00 H HETATM 56 H UNL 1 2.712 -4.442 -4.663 1.00 0.00 H HETATM 57 H UNL 1 3.192 -5.393 -3.256 1.00 0.00 H HETATM 58 H UNL 1 -2.586 0.041 -3.842 1.00 0.00 H HETATM 59 H UNL 1 -2.630 0.222 -2.068 1.00 0.00 H HETATM 60 H UNL 1 -4.864 0.535 -3.238 1.00 0.00 H HETATM 61 H UNL 1 -4.880 -0.607 -1.903 1.00 0.00 H HETATM 62 H UNL 1 -4.531 -2.267 -3.545 1.00 0.00 H CONECT 1 2 6 7 CONECT 2 1 3 8 CONECT 3 2 4 39 CONECT 4 3 5 CONECT 5 4 6 21 CONECT 6 5 1 23 CONECT 7 9 13 1 CONECT 8 2 14 18 CONECT 9 7 10 40 CONECT 10 9 11 41 CONECT 11 10 12 19 CONECT 12 11 13 42 CONECT 13 12 7 43 CONECT 14 8 15 44 CONECT 15 14 16 45 CONECT 16 15 17 46 CONECT 17 16 18 47 CONECT 18 17 8 20 CONECT 19 11 CONECT 20 18 CONECT 21 5 22 24 CONECT 22 21 23 35 CONECT 23 22 6 CONECT 24 21 25 26 CONECT 25 24 CONECT 26 24 31 48 CONECT 27 28 29 30 33 CONECT 28 27 CONECT 29 27 CONECT 30 27 31 49 50 CONECT 31 30 32 26 34 CONECT 32 31 33 51 52 CONECT 33 32 27 53 54 CONECT 34 31 55 56 57 CONECT 35 22 36 CONECT 36 35 37 58 59 CONECT 37 36 38 60 61 CONECT 38 37 62 CONECT 39 3 CONECT 40 9 CONECT 41 10 CONECT 42 12 CONECT 43 13 CONECT 44 14 CONECT 45 15 CONECT 46 16 CONECT 47 17 CONECT 48 26 CONECT 49 30 CONECT 50 30 CONECT 51 32 CONECT 52 32 CONECT 53 33 CONECT 54 33 CONECT 55 34 CONECT 56 34 CONECT 57 34 CONECT 58 36 CONECT 59 36 CONECT 60 37 CONECT 61 37 CONECT 62 38 MASTER 0 0 0 0 0 0 0 0 62 0 62 0 END M END $$$$