D0H5UL AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 13.536 2.561 2.586 1.00 0.00 C HETATM 2 C UNL 1 12.968 1.400 2.077 1.00 0.00 C HETATM 3 C UNL 1 11.567 1.301 1.934 1.00 0.00 C HETATM 4 C UNL 1 10.687 2.377 2.259 1.00 0.00 C HETATM 5 C UNL 1 11.311 3.528 2.778 1.00 0.00 C HETATM 6 C UNL 1 12.700 3.606 2.952 1.00 0.00 C HETATM 7 C UNL 1 9.252 2.418 2.090 1.00 0.00 C HETATM 8 C UNL 1 8.500 3.615 2.276 1.00 0.00 C HETATM 9 C UNL 1 9.234 4.761 2.581 1.00 0.00 C HETATM 10 C UNL 1 10.546 4.660 3.032 1.00 0.00 C HETATM 11 C UNL 1 6.967 3.702 2.146 1.00 0.00 C HETATM 12 N UNL 1 6.328 4.765 2.820 1.00 0.00 N HETATM 13 O UNL 1 6.404 2.807 1.525 1.00 0.00 O HETATM 14 C UNL 1 4.978 5.129 2.818 1.00 0.00 C HETATM 15 S UNL 1 3.873 4.442 1.715 1.00 0.00 S HETATM 16 C UNL 1 2.591 5.382 2.373 1.00 0.00 C HETATM 17 C UNL 1 3.057 6.198 3.383 1.00 0.00 C HETATM 18 N UNL 1 4.451 6.058 3.609 1.00 0.00 N HETATM 19 C UNL 1 2.164 7.019 4.226 1.00 0.00 C HETATM 20 C UNL 1 0.827 7.380 3.959 1.00 0.00 C HETATM 21 C UNL 1 0.176 8.324 4.792 1.00 0.00 C HETATM 22 C UNL 1 0.816 8.707 5.969 1.00 0.00 C HETATM 23 C UNL 1 1.744 7.802 6.427 1.00 0.00 C HETATM 24 C UNL 1 2.664 7.472 5.453 1.00 0.00 C HETATM 25 O UNL 1 8.639 5.970 2.315 1.00 0.00 O HETATM 26 C UNL 1 9.512 7.095 2.263 1.00 0.00 C HETATM 27 O UNL 1 1.051 6.753 7.097 1.00 0.00 O HETATM 28 C UNL 1 1.564 5.420 7.012 1.00 0.00 C HETATM 29 O UNL 1 0.656 9.983 6.419 1.00 0.00 O HETATM 30 C UNL 1 1.682 10.465 7.296 1.00 0.00 C HETATM 31 H UNL 1 14.616 2.662 2.680 1.00 0.00 H HETATM 32 H UNL 1 13.621 0.582 1.782 1.00 0.00 H HETATM 33 H UNL 1 11.173 0.372 1.526 1.00 0.00 H HETATM 34 H UNL 1 13.156 4.520 3.329 1.00 0.00 H HETATM 35 H UNL 1 8.738 1.513 1.762 1.00 0.00 H HETATM 36 H UNL 1 11.023 5.505 3.522 1.00 0.00 H HETATM 37 H UNL 1 6.897 5.375 3.392 1.00 0.00 H HETATM 38 H UNL 1 1.583 5.249 2.014 1.00 0.00 H HETATM 39 H UNL 1 0.303 7.049 3.060 1.00 0.00 H HETATM 40 H UNL 1 -0.762 8.799 4.509 1.00 0.00 H HETATM 41 H UNL 1 3.583 8.049 5.391 1.00 0.00 H HETATM 42 H UNL 1 8.988 7.910 1.759 1.00 0.00 H HETATM 43 H UNL 1 10.443 6.912 1.707 1.00 0.00 H HETATM 44 H UNL 1 9.723 7.397 3.290 1.00 0.00 H HETATM 45 H UNL 1 0.717 4.733 6.885 1.00 0.00 H HETATM 46 H UNL 1 2.064 5.179 7.951 1.00 0.00 H HETATM 47 H UNL 1 2.247 5.219 6.184 1.00 0.00 H HETATM 48 H UNL 1 1.939 11.492 7.011 1.00 0.00 H HETATM 49 H UNL 1 2.622 9.900 7.271 1.00 0.00 H HETATM 50 H UNL 1 1.293 10.479 8.317 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 35 CONECT 8 7 9 11 CONECT 9 25 8 10 CONECT 10 9 5 36 CONECT 11 8 12 13 CONECT 12 11 14 37 CONECT 13 11 CONECT 14 12 15 18 CONECT 15 14 16 CONECT 16 15 17 38 CONECT 17 16 18 19 CONECT 18 17 14 CONECT 19 17 20 24 CONECT 20 19 21 39 CONECT 21 20 22 40 CONECT 22 29 21 23 CONECT 23 27 22 24 CONECT 24 23 19 41 CONECT 25 26 9 CONECT 26 25 42 43 44 CONECT 27 28 23 CONECT 28 27 45 46 47 CONECT 29 30 22 CONECT 30 29 48 49 50 CONECT 31 1 CONECT 32 2 CONECT 33 3 CONECT 34 6 CONECT 35 7 CONECT 36 10 CONECT 37 12 CONECT 38 16 CONECT 39 20 CONECT 40 21 CONECT 41 24 CONECT 42 26 CONECT 43 26 CONECT 44 26 CONECT 45 28 CONECT 46 28 CONECT 47 28 CONECT 48 30 CONECT 49 30 CONECT 50 30 MASTER 0 0 0 0 0 0 0 0 50 0 50 0 END M END $$$$