D0LH9E AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 1.687 -0.111 2.316 1.00 0.00 C HETATM 2 N UNL 1 1.934 0.320 3.619 1.00 0.00 N HETATM 3 C UNL 1 0.870 1.143 3.957 1.00 0.00 C HETATM 4 N UNL 1 -0.232 0.724 3.167 1.00 0.00 N HETATM 5 C UNL 1 0.411 0.683 1.835 1.00 0.00 C HETATM 6 O UNL 1 2.315 -0.916 1.647 1.00 0.00 O HETATM 7 O UNL 1 0.917 2.187 4.591 1.00 0.00 O HETATM 8 C UNL 1 2.571 -0.396 4.672 1.00 0.00 C HETATM 9 C UNL 1 -0.848 -0.606 3.687 1.00 0.00 C HETATM 10 C UNL 1 -2.301 -0.548 4.268 1.00 0.00 C HETATM 11 C UNL 1 -2.833 0.742 4.216 1.00 0.00 C HETATM 12 C UNL 1 -3.041 1.389 5.418 1.00 0.00 C HETATM 13 C UNL 1 -2.762 0.700 6.590 1.00 0.00 C HETATM 14 C UNL 1 -2.837 -0.681 6.598 1.00 0.00 C HETATM 15 C UNL 1 -2.659 -1.361 5.401 1.00 0.00 C HETATM 16 C UNL 1 -3.177 -2.807 5.322 1.00 0.00 C HETATM 17 C UNL 1 -3.360 -3.627 6.618 1.00 0.00 C HETATM 18 C UNL 1 -4.590 -3.926 7.224 1.00 0.00 C HETATM 19 C UNL 1 -4.653 -4.682 8.422 1.00 0.00 C HETATM 20 C UNL 1 -3.529 -5.330 8.909 1.00 0.00 C HETATM 21 C UNL 1 -2.367 -5.200 8.181 1.00 0.00 C HETATM 22 C UNL 1 -2.250 -4.163 7.254 1.00 0.00 C HETATM 23 C UNL 1 3.393 -1.524 4.494 1.00 0.00 C HETATM 24 C UNL 1 3.404 -2.518 5.471 1.00 0.00 C HETATM 25 C UNL 1 2.586 -2.396 6.585 1.00 0.00 C HETATM 26 C UNL 1 2.205 -1.105 6.975 1.00 0.00 C HETATM 27 C UNL 1 2.146 -0.145 5.981 1.00 0.00 C HETATM 28 C UNL 1 0.915 2.085 1.338 1.00 0.00 C HETATM 29 C UNL 1 -0.599 0.208 0.799 1.00 0.00 C HETATM 30 N UNL 1 1.617 -3.475 6.640 1.00 0.00 N1+ HETATM 31 C UNL 1 0.872 -4.377 6.472 1.00 0.00 C1- HETATM 32 C UNL 1 2.084 -0.679 8.400 1.00 0.00 C HETATM 33 F UNL 1 2.322 -1.680 9.275 1.00 0.00 F HETATM 34 F UNL 1 3.021 0.279 8.649 1.00 0.00 F HETATM 35 F UNL 1 0.884 -0.163 8.757 1.00 0.00 F HETATM 36 H UNL 1 -0.221 -0.918 4.532 1.00 0.00 H HETATM 37 H UNL 1 -0.766 -1.391 2.933 1.00 0.00 H HETATM 38 H UNL 1 -2.748 1.351 3.319 1.00 0.00 H HETATM 39 H UNL 1 -3.233 2.456 5.433 1.00 0.00 H HETATM 40 H UNL 1 -2.422 1.231 7.469 1.00 0.00 H HETATM 41 H UNL 1 -3.048 -1.198 7.531 1.00 0.00 H HETATM 42 H UNL 1 -2.542 -3.390 4.640 1.00 0.00 H HETATM 43 H UNL 1 -4.166 -2.760 4.846 1.00 0.00 H HETATM 44 H UNL 1 -5.520 -3.552 6.809 1.00 0.00 H HETATM 45 H UNL 1 -5.599 -4.839 8.934 1.00 0.00 H HETATM 46 H UNL 1 -3.563 -5.986 9.774 1.00 0.00 H HETATM 47 H UNL 1 -1.770 -6.106 8.033 1.00 0.00 H HETATM 48 H UNL 1 -1.361 -3.539 7.307 1.00 0.00 H HETATM 49 H UNL 1 3.964 -1.672 3.588 1.00 0.00 H HETATM 50 H UNL 1 3.881 -3.475 5.285 1.00 0.00 H HETATM 51 H UNL 1 1.759 0.845 6.265 1.00 0.00 H HETATM 52 H UNL 1 1.941 2.311 1.657 1.00 0.00 H HETATM 53 H UNL 1 0.268 2.899 1.681 1.00 0.00 H HETATM 54 H UNL 1 0.948 2.134 0.241 1.00 0.00 H HETATM 55 H UNL 1 -0.878 -0.840 0.900 1.00 0.00 H HETATM 56 H UNL 1 -0.261 0.361 -0.230 1.00 0.00 H HETATM 57 H UNL 1 -1.521 0.804 0.913 1.00 0.00 H CONECT 1 2 5 6 CONECT 2 1 3 8 CONECT 3 2 4 7 CONECT 4 3 5 9 CONECT 5 4 1 28 29 CONECT 6 1 CONECT 7 3 CONECT 8 2 23 27 CONECT 9 4 10 36 37 CONECT 10 9 11 15 CONECT 11 10 12 38 CONECT 12 11 13 39 CONECT 13 12 14 40 CONECT 14 13 15 41 CONECT 15 14 10 16 CONECT 16 15 17 42 43 CONECT 17 16 18 22 CONECT 18 17 19 44 CONECT 19 18 20 45 CONECT 20 19 21 46 CONECT 21 20 22 47 CONECT 22 21 17 48 CONECT 23 8 24 49 CONECT 24 23 25 50 CONECT 25 24 26 30 CONECT 26 25 27 32 CONECT 27 26 8 51 CONECT 28 5 52 53 54 CONECT 29 5 55 56 57 CONECT 30 25 31 CONECT 31 30 CONECT 32 26 33 34 35 CONECT 33 32 CONECT 34 32 CONECT 35 32 CONECT 36 9 CONECT 37 9 CONECT 38 11 CONECT 39 12 CONECT 40 13 CONECT 41 14 CONECT 42 16 CONECT 43 16 CONECT 44 18 CONECT 45 19 CONECT 46 20 CONECT 47 21 CONECT 48 22 CONECT 49 23 CONECT 50 24 CONECT 51 27 CONECT 52 28 CONECT 53 28 CONECT 54 28 CONECT 55 29 CONECT 56 29 CONECT 57 29 MASTER 0 0 0 0 0 0 0 0 57 0 57 0 END M END $$$$