D00BEJ AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 3.259 -0.205 3.474 1.00 0.00 C HETATM 2 C UNL 1 3.549 0.258 4.715 1.00 0.00 C HETATM 3 C UNL 1 3.309 1.756 5.036 1.00 0.00 C HETATM 4 C UNL 1 3.575 2.571 3.843 1.00 0.00 C HETATM 5 C UNL 1 3.145 2.069 2.619 1.00 0.00 C HETATM 6 C UNL 1 2.494 0.758 2.630 1.00 0.00 C HETATM 7 C UNL 1 4.429 3.655 3.890 1.00 0.00 C HETATM 8 C UNL 1 4.702 4.327 2.717 1.00 0.00 C HETATM 9 C UNL 1 4.620 3.589 1.546 1.00 0.00 C HETATM 10 C UNL 1 3.741 2.520 1.448 1.00 0.00 C HETATM 11 S UNL 1 4.266 -1.247 2.488 1.00 0.00 S HETATM 12 C UNL 1 4.093 -2.984 2.981 1.00 0.00 C HETATM 13 C UNL 1 4.623 -3.931 1.902 1.00 0.00 C HETATM 14 O UNL 1 4.398 -3.505 0.605 1.00 0.00 O HETATM 15 O UNL 1 5.197 -5.021 2.113 1.00 0.00 O HETATM 16 O UNL 1 1.530 0.472 1.942 1.00 0.00 O HETATM 17 N UNL 1 2.991 2.226 6.189 1.00 0.00 N HETATM 18 S UNL 1 2.885 3.758 6.747 1.00 0.00 S HETATM 19 C UNL 1 1.684 4.939 5.907 1.00 0.00 C HETATM 20 O UNL 1 2.317 3.589 8.064 1.00 0.00 O HETATM 21 O UNL 1 4.175 4.395 6.651 1.00 0.00 O HETATM 22 C UNL 1 1.278 4.990 4.550 1.00 0.00 C HETATM 23 C UNL 1 0.267 4.101 4.217 1.00 0.00 C HETATM 24 C UNL 1 -0.618 3.840 5.268 1.00 0.00 C HETATM 25 C UNL 1 -0.598 4.764 6.353 1.00 0.00 C HETATM 26 C UNL 1 0.651 5.186 6.785 1.00 0.00 C HETATM 27 C UNL 1 -0.500 2.337 5.573 1.00 0.00 C HETATM 28 C UNL 1 0.785 6.389 3.964 1.00 0.00 C HETATM 29 C UNL 1 -1.650 5.846 6.538 1.00 0.00 C HETATM 30 H UNL 1 4.242 -0.244 5.385 1.00 0.00 H HETATM 31 H UNL 1 4.971 3.950 4.776 1.00 0.00 H HETATM 32 H UNL 1 4.149 5.289 2.682 1.00 0.00 H HETATM 33 H UNL 1 5.479 3.615 0.874 1.00 0.00 H HETATM 34 H UNL 1 3.688 1.926 0.543 1.00 0.00 H HETATM 35 H UNL 1 3.057 -3.252 3.173 1.00 0.00 H HETATM 36 H UNL 1 4.707 -3.123 3.872 1.00 0.00 H HETATM 37 H UNL 1 3.962 -2.628 0.600 1.00 0.00 H HETATM 38 H UNL 1 -0.098 3.973 3.198 1.00 0.00 H HETATM 39 H UNL 1 0.814 5.607 7.771 1.00 0.00 H HETATM 40 H UNL 1 -0.920 1.750 4.751 1.00 0.00 H HETATM 41 H UNL 1 -0.953 2.061 6.524 1.00 0.00 H HETATM 42 H UNL 1 0.563 2.071 5.632 1.00 0.00 H HETATM 43 H UNL 1 1.130 7.240 4.557 1.00 0.00 H HETATM 44 H UNL 1 -0.322 6.446 3.986 1.00 0.00 H HETATM 45 H UNL 1 1.068 6.505 2.915 1.00 0.00 H HETATM 46 H UNL 1 -2.426 5.795 5.770 1.00 0.00 H HETATM 47 H UNL 1 -1.177 6.837 6.423 1.00 0.00 H HETATM 48 H UNL 1 -2.088 5.808 7.537 1.00 0.00 H CONECT 1 2 6 11 CONECT 2 1 3 30 CONECT 3 2 4 17 CONECT 4 3 5 7 CONECT 5 4 6 10 CONECT 6 5 1 16 CONECT 7 4 8 31 CONECT 8 7 9 32 CONECT 9 8 10 33 CONECT 10 9 5 34 CONECT 11 1 12 CONECT 12 11 13 35 36 CONECT 13 12 14 15 CONECT 14 13 37 CONECT 15 13 CONECT 16 6 CONECT 17 3 18 CONECT 18 17 19 20 21 CONECT 19 18 22 26 CONECT 20 18 CONECT 21 18 CONECT 22 19 23 28 CONECT 23 22 24 38 CONECT 24 23 25 27 CONECT 25 24 26 29 CONECT 26 25 19 39 CONECT 27 24 40 41 42 CONECT 28 22 43 44 45 CONECT 29 25 46 47 48 CONECT 30 2 CONECT 31 7 CONECT 32 8 CONECT 33 9 CONECT 34 10 CONECT 35 12 CONECT 36 12 CONECT 37 14 CONECT 38 23 CONECT 39 26 CONECT 40 27 CONECT 41 27 CONECT 42 27 CONECT 43 28 CONECT 44 28 CONECT 45 28 CONECT 46 29 CONECT 47 29 CONECT 48 29 MASTER 0 0 0 0 0 0 0 0 48 0 48 0 END M END $$$$