D0OE9W AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 14.979 12.353 -0.010 1.00 0.00 C HETATM 2 C UNL 1 14.904 13.746 -0.137 1.00 0.00 C HETATM 3 C UNL 1 13.799 14.201 -0.893 1.00 0.00 C HETATM 4 C UNL 1 12.728 13.370 -1.282 1.00 0.00 C HETATM 5 C UNL 1 12.738 12.004 -1.022 1.00 0.00 C HETATM 6 C UNL 1 13.918 11.498 -0.445 1.00 0.00 C HETATM 7 N UNL 1 11.579 11.236 -1.343 1.00 0.00 N HETATM 8 C UNL 1 11.494 9.865 -1.714 1.00 0.00 C HETATM 9 C UNL 1 12.585 9.349 -2.373 1.00 0.00 C HETATM 10 C UNL 1 12.666 7.996 -2.386 1.00 0.00 C HETATM 11 N UNL 1 11.681 7.184 -2.019 1.00 0.00 N HETATM 12 C UNL 1 10.539 7.766 -1.639 1.00 0.00 C HETATM 13 N UNL 1 10.397 9.098 -1.415 1.00 0.00 N HETATM 14 S UNL 1 9.264 6.546 -1.421 1.00 0.00 S HETATM 15 C UNL 1 7.624 7.341 -1.395 1.00 0.00 C HETATM 16 C UNL 1 7.338 8.211 -2.603 1.00 0.00 C HETATM 17 O UNL 1 6.564 7.883 -3.500 1.00 0.00 O HETATM 18 O UNL 1 7.964 9.404 -2.620 1.00 0.00 O HETATM 19 C UNL 1 7.342 7.973 -0.035 1.00 0.00 C HETATM 20 C UNL 1 5.863 8.319 0.171 1.00 0.00 C HETATM 21 C UNL 1 5.649 8.926 1.550 1.00 0.00 C HETATM 22 CL UNL 1 14.156 7.229 -2.737 1.00 0.00 Cl HETATM 23 C UNL 1 15.840 14.756 0.503 1.00 0.00 C HETATM 24 C UNL 1 17.137 14.495 0.980 1.00 0.00 C HETATM 25 C UNL 1 17.945 15.515 1.554 1.00 0.00 C HETATM 26 C UNL 1 17.494 16.826 1.661 1.00 0.00 C HETATM 27 C UNL 1 16.199 17.110 1.246 1.00 0.00 C HETATM 28 C UNL 1 15.391 16.083 0.708 1.00 0.00 C HETATM 29 C UNL 1 18.329 17.885 2.204 1.00 0.00 C HETATM 30 N UNL 1 18.996 18.727 2.638 1.00 0.00 N HETATM 31 H UNL 1 15.842 11.881 0.464 1.00 0.00 H HETATM 32 H UNL 1 13.731 15.243 -1.187 1.00 0.00 H HETATM 33 H UNL 1 11.889 13.820 -1.806 1.00 0.00 H HETATM 34 H UNL 1 14.032 10.429 -0.276 1.00 0.00 H HETATM 35 H UNL 1 10.759 11.539 -0.825 1.00 0.00 H HETATM 36 H UNL 1 13.387 9.974 -2.738 1.00 0.00 H HETATM 37 H UNL 1 6.929 6.493 -1.493 1.00 0.00 H HETATM 38 H UNL 1 8.647 9.507 -1.923 1.00 0.00 H HETATM 39 H UNL 1 7.952 8.870 0.113 1.00 0.00 H HETATM 40 H UNL 1 7.621 7.258 0.753 1.00 0.00 H HETATM 41 H UNL 1 5.251 7.413 0.079 1.00 0.00 H HETATM 42 H UNL 1 5.517 9.024 -0.593 1.00 0.00 H HETATM 43 H UNL 1 6.127 8.322 2.328 1.00 0.00 H HETATM 44 H UNL 1 4.582 8.994 1.780 1.00 0.00 H HETATM 45 H UNL 1 6.073 9.935 1.593 1.00 0.00 H HETATM 46 H UNL 1 17.565 13.492 0.925 1.00 0.00 H HETATM 47 H UNL 1 18.945 15.263 1.922 1.00 0.00 H HETATM 48 H UNL 1 15.783 18.109 1.332 1.00 0.00 H HETATM 49 H UNL 1 14.372 16.362 0.469 1.00 0.00 H CONECT 1 2 6 31 CONECT 2 1 3 23 CONECT 3 2 4 32 CONECT 4 3 5 33 CONECT 5 4 6 7 CONECT 6 5 1 34 CONECT 7 5 8 35 CONECT 8 7 9 13 CONECT 9 8 10 36 CONECT 10 9 11 22 CONECT 11 10 12 CONECT 12 11 13 14 CONECT 13 12 8 CONECT 14 12 15 CONECT 15 19 16 14 37 CONECT 16 17 18 15 CONECT 17 16 CONECT 18 16 38 CONECT 19 15 20 39 40 CONECT 20 19 21 41 42 CONECT 21 20 43 44 45 CONECT 22 10 CONECT 23 2 24 28 CONECT 24 23 25 46 CONECT 25 24 26 47 CONECT 26 25 27 29 CONECT 27 26 28 48 CONECT 28 27 23 49 CONECT 29 26 30 CONECT 30 29 CONECT 31 1 CONECT 32 3 CONECT 33 4 CONECT 34 6 CONECT 35 7 CONECT 36 9 CONECT 37 15 CONECT 38 18 CONECT 39 19 CONECT 40 19 CONECT 41 20 CONECT 42 20 CONECT 43 21 CONECT 44 21 CONECT 45 21 CONECT 46 24 CONECT 47 25 CONECT 48 27 CONECT 49 28 MASTER 0 0 0 0 0 0 0 0 49 0 49 0 END M END $$$$