D0CM5P AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.890 1.916 2.706 1.00 0.00 C HETATM 2 C UNL 1 4.093 2.401 3.256 1.00 0.00 C HETATM 3 C UNL 1 5.258 1.636 3.251 1.00 0.00 C HETATM 4 C UNL 1 5.275 0.384 2.629 1.00 0.00 C HETATM 5 C UNL 1 4.071 -0.061 2.055 1.00 0.00 C HETATM 6 C UNL 1 2.868 0.647 2.135 1.00 0.00 C HETATM 7 N UNL 1 6.532 -0.186 2.272 1.00 0.00 N HETATM 8 C UNL 1 6.606 -0.606 1.033 1.00 0.00 C HETATM 9 N UNL 1 5.471 -0.525 0.197 1.00 0.00 N HETATM 10 C UNL 1 4.317 -0.924 0.881 1.00 0.00 C HETATM 11 O UNL 1 3.607 -1.886 0.611 1.00 0.00 O HETATM 12 N UNL 1 5.373 0.894 -0.208 1.00 0.00 N HETATM 13 C UNL 1 4.180 1.519 -0.592 1.00 0.00 C HETATM 14 C UNL 1 4.204 3.070 -0.658 1.00 0.00 C HETATM 15 O UNL 1 3.164 0.915 -0.921 1.00 0.00 O HETATM 16 C UNL 1 5.424 3.601 -0.274 1.00 0.00 C HETATM 17 C UNL 1 6.465 3.335 -1.158 1.00 0.00 C HETATM 18 C UNL 1 6.149 3.162 -2.512 1.00 0.00 C HETATM 19 C UNL 1 4.810 3.375 -2.918 1.00 0.00 C HETATM 20 C UNL 1 3.824 3.426 -1.936 1.00 0.00 C HETATM 21 BR UNL 1 2.010 3.782 -2.301 1.00 0.00 Br HETATM 22 C UNL 1 7.916 -1.010 0.394 1.00 0.00 C HETATM 23 C UNL 1 9.000 -1.492 1.154 1.00 0.00 C HETATM 24 C UNL 1 10.205 -1.873 0.535 1.00 0.00 C HETATM 25 C UNL 1 10.334 -1.779 -0.837 1.00 0.00 C HETATM 26 C UNL 1 9.299 -1.254 -1.610 1.00 0.00 C HETATM 27 C UNL 1 8.100 -0.857 -0.990 1.00 0.00 C HETATM 28 F UNL 1 11.470 -2.164 -1.434 1.00 0.00 F HETATM 29 O UNL 1 7.506 2.782 -0.467 1.00 0.00 O HETATM 30 C UNL 1 8.851 2.962 -0.843 1.00 0.00 C HETATM 31 H UNL 1 2.013 2.558 2.635 1.00 0.00 H HETATM 32 H UNL 1 4.120 3.441 3.605 1.00 0.00 H HETATM 33 H UNL 1 6.180 2.058 3.631 1.00 0.00 H HETATM 34 H UNL 1 1.990 0.313 1.577 1.00 0.00 H HETATM 35 H UNL 1 6.111 1.458 0.216 1.00 0.00 H HETATM 36 H UNL 1 5.651 3.701 0.785 1.00 0.00 H HETATM 37 H UNL 1 6.858 2.775 -3.235 1.00 0.00 H HETATM 38 H UNL 1 4.513 3.373 -3.963 1.00 0.00 H HETATM 39 H UNL 1 8.918 -1.563 2.235 1.00 0.00 H HETATM 40 H UNL 1 11.046 -2.238 1.124 1.00 0.00 H HETATM 41 H UNL 1 9.431 -1.152 -2.674 1.00 0.00 H HETATM 42 H UNL 1 7.350 -0.383 -1.605 1.00 0.00 H HETATM 43 H UNL 1 9.206 2.094 -1.403 1.00 0.00 H HETATM 44 H UNL 1 9.416 2.985 0.098 1.00 0.00 H HETATM 45 H UNL 1 9.037 3.898 -1.373 1.00 0.00 H CONECT 1 2 6 31 CONECT 2 1 3 32 CONECT 3 2 4 33 CONECT 4 3 5 7 CONECT 5 4 6 10 CONECT 6 5 1 34 CONECT 7 4 8 CONECT 8 7 9 22 CONECT 9 8 10 12 CONECT 10 9 5 11 CONECT 11 10 CONECT 12 9 13 35 CONECT 13 12 14 15 CONECT 14 13 16 20 CONECT 15 13 CONECT 16 14 17 36 CONECT 17 16 18 29 CONECT 18 17 19 37 CONECT 19 18 20 38 CONECT 20 19 14 21 CONECT 21 20 CONECT 22 8 23 27 CONECT 23 22 24 39 CONECT 24 23 25 40 CONECT 25 24 26 28 CONECT 26 25 27 41 CONECT 27 26 22 42 CONECT 28 25 CONECT 29 17 30 CONECT 30 29 43 44 45 CONECT 31 1 CONECT 32 2 CONECT 33 3 CONECT 34 6 CONECT 35 12 CONECT 36 16 CONECT 37 18 CONECT 38 19 CONECT 39 23 CONECT 40 24 CONECT 41 26 CONECT 42 27 CONECT 43 30 CONECT 44 30 CONECT 45 30 MASTER 0 0 0 0 0 0 0 0 45 0 45 0 END M END $$$$