D0KA3X AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 4.959 4.790 -1.619 1.00 0.00 C HETATM 2 C UNL 1 6.005 4.002 -2.101 1.00 0.00 C HETATM 3 C UNL 1 6.591 3.053 -1.259 1.00 0.00 C HETATM 4 N UNL 1 6.297 3.034 0.063 1.00 0.00 N HETATM 5 C UNL 1 5.315 3.833 0.516 1.00 0.00 C HETATM 6 C UNL 1 4.579 4.669 -0.295 1.00 0.00 C HETATM 7 N UNL 1 7.313 1.979 -1.831 1.00 0.00 N HETATM 8 C UNL 1 7.880 1.037 -0.847 1.00 0.00 C HETATM 9 C UNL 1 8.181 2.094 -2.941 1.00 0.00 C HETATM 10 C UNL 1 8.200 1.054 -3.876 1.00 0.00 C HETATM 11 C UNL 1 9.238 0.985 -4.799 1.00 0.00 C HETATM 12 C UNL 1 10.215 1.970 -4.784 1.00 0.00 C HETATM 13 C UNL 1 10.061 3.028 -3.905 1.00 0.00 C HETATM 14 N UNL 1 9.067 3.111 -2.996 1.00 0.00 N HETATM 15 C UNL 1 6.816 0.084 -0.273 1.00 0.00 C HETATM 16 C UNL 1 7.370 -0.815 0.833 1.00 0.00 C HETATM 17 C UNL 1 8.470 -1.783 0.372 1.00 0.00 C HETATM 18 C UNL 1 8.943 -2.631 1.551 1.00 0.00 C HETATM 19 C UNL 1 10.043 -3.609 1.151 1.00 0.00 C HETATM 20 C UNL 1 10.635 -4.336 2.346 1.00 0.00 C HETATM 21 N UNL 1 9.730 -4.827 3.248 1.00 0.00 N HETATM 22 O UNL 1 11.844 -4.509 2.488 1.00 0.00 O HETATM 23 O UNL 1 10.246 -5.430 4.413 1.00 0.00 O HETATM 24 H UNL 1 4.427 5.449 -2.297 1.00 0.00 H HETATM 25 H UNL 1 6.297 4.069 -3.143 1.00 0.00 H HETATM 26 H UNL 1 5.111 3.757 1.580 1.00 0.00 H HETATM 27 H UNL 1 3.719 5.207 0.094 1.00 0.00 H HETATM 28 H UNL 1 8.410 1.574 -0.051 1.00 0.00 H HETATM 29 H UNL 1 8.641 0.403 -1.323 1.00 0.00 H HETATM 30 H UNL 1 7.436 0.283 -3.850 1.00 0.00 H HETATM 31 H UNL 1 9.298 0.156 -5.497 1.00 0.00 H HETATM 32 H UNL 1 11.076 1.916 -5.439 1.00 0.00 H HETATM 33 H UNL 1 10.767 3.853 -3.889 1.00 0.00 H HETATM 34 H UNL 1 6.384 -0.522 -1.078 1.00 0.00 H HETATM 35 H UNL 1 5.977 0.645 0.155 1.00 0.00 H HETATM 36 H UNL 1 6.533 -1.394 1.246 1.00 0.00 H HETATM 37 H UNL 1 7.749 -0.190 1.649 1.00 0.00 H HETATM 38 H UNL 1 9.323 -1.224 -0.020 1.00 0.00 H HETATM 39 H UNL 1 8.088 -2.424 -0.426 1.00 0.00 H HETATM 40 H UNL 1 8.081 -3.175 1.953 1.00 0.00 H HETATM 41 H UNL 1 9.308 -1.974 2.351 1.00 0.00 H HETATM 42 H UNL 1 10.864 -3.058 0.671 1.00 0.00 H HETATM 43 H UNL 1 9.680 -4.352 0.440 1.00 0.00 H HETATM 44 H UNL 1 8.725 -4.695 3.218 1.00 0.00 H HETATM 45 H UNL 1 11.215 -5.301 4.306 1.00 0.00 H CONECT 1 2 6 24 CONECT 2 1 3 25 CONECT 3 2 4 7 CONECT 4 3 5 CONECT 5 4 6 26 CONECT 6 5 1 27 CONECT 7 3 8 9 CONECT 8 7 15 28 29 CONECT 9 7 10 14 CONECT 10 9 11 30 CONECT 11 10 12 31 CONECT 12 11 13 32 CONECT 13 12 14 33 CONECT 14 13 9 CONECT 15 8 16 34 35 CONECT 16 15 17 36 37 CONECT 17 16 18 38 39 CONECT 18 17 19 40 41 CONECT 19 18 20 42 43 CONECT 20 19 21 22 CONECT 21 20 23 44 CONECT 22 20 CONECT 23 21 45 CONECT 24 1 CONECT 25 2 CONECT 26 5 CONECT 27 6 CONECT 28 8 CONECT 29 8 CONECT 30 10 CONECT 31 11 CONECT 32 12 CONECT 33 13 CONECT 34 15 CONECT 35 15 CONECT 36 16 CONECT 37 16 CONECT 38 17 CONECT 39 17 CONECT 40 18 CONECT 41 18 CONECT 42 19 CONECT 43 19 CONECT 44 21 CONECT 45 23 MASTER 0 0 0 0 0 0 0 0 45 0 45 0 END M END $$$$