D0H4HR AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 1.303 0.575 -0.132 1.00 0.00 C HETATM 2 C UNL 1 0.774 1.810 0.266 1.00 0.00 C HETATM 3 C UNL 1 1.616 2.907 0.336 1.00 0.00 C HETATM 4 C UNL 1 2.945 2.811 -0.048 1.00 0.00 C HETATM 5 C UNL 1 3.475 1.616 -0.510 1.00 0.00 C HETATM 6 C UNL 1 2.645 0.481 -0.552 1.00 0.00 C HETATM 7 O UNL 1 1.284 4.166 0.794 1.00 0.00 O HETATM 8 C UNL 1 2.579 4.797 1.045 1.00 0.00 C HETATM 9 C UNL 1 3.580 4.147 0.070 1.00 0.00 C HETATM 10 BR UNL 1 -1.068 1.957 0.651 1.00 0.00 Br HETATM 11 C UNL 1 2.957 4.560 2.516 1.00 0.00 C HETATM 12 C UNL 1 2.460 6.305 0.799 1.00 0.00 C HETATM 13 C UNL 1 3.234 -0.787 -1.086 1.00 0.00 C HETATM 14 N UNL 1 2.380 -1.636 -1.767 1.00 0.00 N HETATM 15 O UNL 1 4.431 -0.997 -0.943 1.00 0.00 O HETATM 16 C UNL 1 2.838 -2.918 -2.262 1.00 0.00 C HETATM 17 C UNL 1 2.201 -3.373 -3.556 1.00 0.00 C HETATM 18 C UNL 1 2.455 -4.841 -3.777 1.00 0.00 C HETATM 19 N UNL 1 1.727 -5.461 -4.754 1.00 0.00 N HETATM 20 C UNL 1 1.052 -4.794 -5.739 1.00 0.00 C HETATM 21 C UNL 1 0.972 -3.457 -5.665 1.00 0.00 C HETATM 22 C UNL 1 1.473 -2.725 -4.494 1.00 0.00 C HETATM 23 C UNL 1 1.113 -1.268 -4.452 1.00 0.00 C HETATM 24 C UNL 1 0.544 -5.616 -6.887 1.00 0.00 C HETATM 25 O UNL 1 3.262 -5.477 -3.099 1.00 0.00 O HETATM 26 H UNL 1 0.673 -0.308 -0.096 1.00 0.00 H HETATM 27 H UNL 1 4.511 1.555 -0.836 1.00 0.00 H HETATM 28 H UNL 1 4.601 4.122 0.460 1.00 0.00 H HETATM 29 H UNL 1 3.568 4.635 -0.911 1.00 0.00 H HETATM 30 H UNL 1 2.873 3.504 2.794 1.00 0.00 H HETATM 31 H UNL 1 2.281 5.104 3.184 1.00 0.00 H HETATM 32 H UNL 1 3.980 4.892 2.721 1.00 0.00 H HETATM 33 H UNL 1 2.049 6.520 -0.190 1.00 0.00 H HETATM 34 H UNL 1 3.437 6.796 0.888 1.00 0.00 H HETATM 35 H UNL 1 1.782 6.769 1.525 1.00 0.00 H HETATM 36 H UNL 1 1.384 -1.485 -1.725 1.00 0.00 H HETATM 37 H UNL 1 3.931 -2.918 -2.360 1.00 0.00 H HETATM 38 H UNL 1 2.579 -3.632 -1.464 1.00 0.00 H HETATM 39 H UNL 1 1.870 -6.461 -4.822 1.00 0.00 H HETATM 40 H UNL 1 0.524 -2.893 -6.481 1.00 0.00 H HETATM 41 H UNL 1 0.562 -0.946 -5.346 1.00 0.00 H HETATM 42 H UNL 1 2.009 -0.641 -4.384 1.00 0.00 H HETATM 43 H UNL 1 0.455 -1.062 -3.602 1.00 0.00 H HETATM 44 H UNL 1 1.013 -6.607 -6.900 1.00 0.00 H HETATM 45 H UNL 1 0.775 -5.140 -7.843 1.00 0.00 H HETATM 46 H UNL 1 -0.538 -5.763 -6.812 1.00 0.00 H CONECT 1 2 6 26 CONECT 2 1 3 10 CONECT 3 2 4 7 CONECT 4 3 5 9 CONECT 5 4 6 27 CONECT 6 5 1 13 CONECT 7 3 8 CONECT 8 7 9 11 12 CONECT 9 8 4 28 29 CONECT 10 2 CONECT 11 8 30 31 32 CONECT 12 8 33 34 35 CONECT 13 6 14 15 CONECT 14 13 16 36 CONECT 15 13 CONECT 16 14 17 37 38 CONECT 17 16 18 22 CONECT 18 17 19 25 CONECT 19 18 20 39 CONECT 20 19 21 24 CONECT 21 20 22 40 CONECT 22 21 17 23 CONECT 23 22 41 42 43 CONECT 24 20 44 45 46 CONECT 25 18 CONECT 26 1 CONECT 27 5 CONECT 28 9 CONECT 29 9 CONECT 30 11 CONECT 31 11 CONECT 32 11 CONECT 33 12 CONECT 34 12 CONECT 35 12 CONECT 36 14 CONECT 37 16 CONECT 38 16 CONECT 39 19 CONECT 40 21 CONECT 41 23 CONECT 42 23 CONECT 43 23 CONECT 44 24 CONECT 45 24 CONECT 46 24 MASTER 0 0 0 0 0 0 0 0 46 0 46 0 END M END $$$$