D0KB4T AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.635 0.766 -2.383 1.00 0.00 C HETATM 2 C UNL 1 3.435 0.608 -3.521 1.00 0.00 C HETATM 3 C UNL 1 3.880 -0.697 -3.721 1.00 0.00 C HETATM 4 C UNL 1 3.058 -1.756 -3.328 1.00 0.00 C HETATM 5 C UNL 1 1.834 -1.482 -2.726 1.00 0.00 C HETATM 6 C UNL 1 1.602 -0.192 -2.232 1.00 0.00 C HETATM 7 C UNL 1 0.257 0.090 -1.629 1.00 0.00 C HETATM 8 S UNL 1 3.834 0.792 -0.852 1.00 0.00 S HETATM 9 O UNL 1 3.472 -0.359 -0.053 1.00 0.00 O HETATM 10 O UNL 1 5.190 0.956 -1.340 1.00 0.00 O HETATM 11 N UNL 1 3.430 2.153 0.032 1.00 0.00 N HETATM 12 C UNL 1 4.242 3.391 0.105 1.00 0.00 C HETATM 13 C UNL 1 3.543 4.619 -0.523 1.00 0.00 C HETATM 14 O UNL 1 2.111 4.657 -0.379 1.00 0.00 O HETATM 15 C UNL 1 1.528 3.386 -0.686 1.00 0.00 C HETATM 16 C UNL 1 2.025 2.387 0.356 1.00 0.00 C HETATM 17 N UNL 1 5.249 -0.943 -3.900 1.00 0.00 N HETATM 18 C UNL 1 6.095 -0.243 -4.737 1.00 0.00 C HETATM 19 O UNL 1 5.714 0.497 -5.642 1.00 0.00 O HETATM 20 C UNL 1 7.512 -0.534 -4.530 1.00 0.00 C HETATM 21 C UNL 1 8.573 -0.459 -5.455 1.00 0.00 C HETATM 22 N UNL 1 9.763 -0.789 -4.930 1.00 0.00 N HETATM 23 N UNL 1 9.503 -1.038 -3.617 1.00 0.00 N HETATM 24 C UNL 1 8.143 -0.925 -3.366 1.00 0.00 C HETATM 25 C UNL 1 10.531 -1.360 -2.669 1.00 0.00 C HETATM 26 C UNL 1 11.883 -1.484 -3.048 1.00 0.00 C HETATM 27 C UNL 1 12.875 -1.789 -2.084 1.00 0.00 C HETATM 28 C UNL 1 12.518 -1.973 -0.748 1.00 0.00 C HETATM 29 C UNL 1 11.177 -1.843 -0.394 1.00 0.00 C HETATM 30 C UNL 1 10.194 -1.548 -1.323 1.00 0.00 C HETATM 31 O UNL 1 13.316 -2.266 0.319 1.00 0.00 O HETATM 32 C UNL 1 14.714 -2.413 0.141 1.00 0.00 C HETATM 33 H UNL 1 3.000 1.038 -4.440 1.00 0.00 H HETATM 34 H UNL 1 3.346 -2.786 -3.515 1.00 0.00 H HETATM 35 H UNL 1 1.110 -2.277 -2.563 1.00 0.00 H HETATM 36 H UNL 1 -0.520 0.019 -2.400 1.00 0.00 H HETATM 37 H UNL 1 0.174 1.090 -1.208 1.00 0.00 H HETATM 38 H UNL 1 0.026 -0.634 -0.840 1.00 0.00 H HETATM 39 H UNL 1 5.247 3.272 -0.309 1.00 0.00 H HETATM 40 H UNL 1 4.387 3.597 1.175 1.00 0.00 H HETATM 41 H UNL 1 3.783 4.696 -1.588 1.00 0.00 H HETATM 42 H UNL 1 3.921 5.529 -0.041 1.00 0.00 H HETATM 43 H UNL 1 1.821 3.119 -1.709 1.00 0.00 H HETATM 44 H UNL 1 0.440 3.471 -0.665 1.00 0.00 H HETATM 45 H UNL 1 1.475 1.447 0.375 1.00 0.00 H HETATM 46 H UNL 1 1.960 2.807 1.365 1.00 0.00 H HETATM 47 H UNL 1 5.653 -1.622 -3.268 1.00 0.00 H HETATM 48 H UNL 1 8.513 -0.191 -6.504 1.00 0.00 H HETATM 49 H UNL 1 7.738 -1.083 -2.380 1.00 0.00 H HETATM 50 H UNL 1 12.175 -1.345 -4.091 1.00 0.00 H HETATM 51 H UNL 1 13.909 -1.882 -2.406 1.00 0.00 H HETATM 52 H UNL 1 10.891 -1.975 0.654 1.00 0.00 H HETATM 53 H UNL 1 9.188 -1.454 -0.956 1.00 0.00 H HETATM 54 H UNL 1 15.140 -2.609 1.133 1.00 0.00 H HETATM 55 H UNL 1 15.172 -1.495 -0.236 1.00 0.00 H HETATM 56 H UNL 1 14.949 -3.274 -0.492 1.00 0.00 H CONECT 1 2 6 8 CONECT 2 1 3 33 CONECT 3 2 4 17 CONECT 4 3 5 34 CONECT 5 4 6 35 CONECT 6 5 1 7 CONECT 7 6 36 37 38 CONECT 8 1 9 10 11 CONECT 9 8 CONECT 10 8 CONECT 11 8 12 16 CONECT 12 11 13 39 40 CONECT 13 12 14 41 42 CONECT 14 13 15 CONECT 15 14 16 43 44 CONECT 16 15 11 45 46 CONECT 17 3 18 47 CONECT 18 17 19 20 CONECT 19 18 CONECT 20 18 21 24 CONECT 21 20 22 48 CONECT 22 21 23 CONECT 23 22 24 25 CONECT 24 23 20 49 CONECT 25 23 26 30 CONECT 26 25 27 50 CONECT 27 26 28 51 CONECT 28 27 29 31 CONECT 29 28 30 52 CONECT 30 29 25 53 CONECT 31 28 32 CONECT 32 31 54 55 56 CONECT 33 2 CONECT 34 4 CONECT 35 5 CONECT 36 7 CONECT 37 7 CONECT 38 7 CONECT 39 12 CONECT 40 12 CONECT 41 13 CONECT 42 13 CONECT 43 15 CONECT 44 15 CONECT 45 16 CONECT 46 16 CONECT 47 17 CONECT 48 21 CONECT 49 24 CONECT 50 26 CONECT 51 27 CONECT 52 29 CONECT 53 30 CONECT 54 32 CONECT 55 32 CONECT 56 32 MASTER 0 0 0 0 0 0 0 0 56 0 56 0 END M END $$$$