D0V2JR AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 3.372 2.270 -0.571 1.00 0.00 C HETATM 2 C UNL 1 4.702 2.768 -1.191 1.00 0.00 C HETATM 3 C UNL 1 5.884 2.342 -0.231 1.00 0.00 C HETATM 4 C UNL 1 6.114 0.770 -0.219 1.00 0.00 C HETATM 5 C UNL 1 4.737 0.123 -0.410 1.00 0.00 C HETATM 6 C UNL 1 3.729 1.023 0.301 1.00 0.00 C HETATM 7 C UNL 1 2.481 2.084 -1.802 1.00 0.00 C HETATM 8 C UNL 1 3.478 1.681 -2.849 1.00 0.00 C HETATM 9 O UNL 1 4.728 2.159 -2.489 1.00 0.00 O HETATM 10 C UNL 1 7.127 0.352 -1.288 1.00 0.00 C HETATM 11 C UNL 1 7.341 -1.148 -1.406 1.00 0.00 C HETATM 12 C UNL 1 6.095 -1.954 -1.822 1.00 0.00 C HETATM 13 C UNL 1 5.086 -2.289 -0.687 1.00 0.00 C HETATM 14 N UNL 1 4.251 -1.239 -0.098 1.00 0.00 N HETATM 15 C UNL 1 2.759 -1.036 -0.336 1.00 0.00 C HETATM 16 C UNL 1 2.700 0.050 0.761 1.00 0.00 C HETATM 17 O UNL 1 3.231 1.019 -3.846 1.00 0.00 O HETATM 18 H UNL 1 2.939 3.021 0.100 1.00 0.00 H HETATM 19 H UNL 1 4.591 0.148 -1.488 1.00 0.00 H HETATM 20 H UNL 1 6.510 0.492 0.767 1.00 0.00 H HETATM 21 C UNL 1 7.190 3.137 -0.235 1.00 0.00 C HETATM 22 H UNL 1 4.681 3.849 -1.353 1.00 0.00 H HETATM 23 C UNL 1 7.026 4.555 0.323 1.00 0.00 C HETATM 24 H UNL 1 4.116 1.393 1.261 1.00 0.00 H HETATM 25 C UNL 1 1.817 3.359 -2.331 1.00 0.00 C HETATM 26 C UNL 1 1.325 -1.677 -0.248 1.00 0.00 C HETATM 27 H UNL 1 2.714 -0.624 -1.350 1.00 0.00 H HETATM 28 O UNL 1 0.419 -0.502 -0.105 1.00 0.00 O HETATM 29 C UNL 1 -0.733 -0.583 -0.805 1.00 0.00 C HETATM 30 C UNL 1 -0.810 -1.966 -1.358 1.00 0.00 C HETATM 31 C UNL 1 0.697 -2.316 -1.486 1.00 0.00 C HETATM 32 H UNL 1 1.185 -2.263 0.667 1.00 0.00 H HETATM 33 C UNL 1 -1.627 -2.006 -2.624 1.00 0.00 C HETATM 34 O UNL 1 -1.568 0.303 -0.889 1.00 0.00 O HETATM 35 H UNL 1 5.509 2.600 0.771 1.00 0.00 H HETATM 36 H UNL 1 1.710 1.322 -1.642 1.00 0.00 H HETATM 37 H UNL 1 6.839 0.751 -2.270 1.00 0.00 H HETATM 38 H UNL 1 8.098 0.807 -1.061 1.00 0.00 H HETATM 39 H UNL 1 7.770 -1.535 -0.474 1.00 0.00 H HETATM 40 H UNL 1 8.116 -1.290 -2.173 1.00 0.00 H HETATM 41 H UNL 1 6.477 -2.906 -2.213 1.00 0.00 H HETATM 42 H UNL 1 5.592 -1.466 -2.664 1.00 0.00 H HETATM 43 H UNL 1 5.718 -2.649 0.140 1.00 0.00 H HETATM 44 H UNL 1 4.486 -3.158 -0.974 1.00 0.00 H HETATM 45 H UNL 1 3.014 -0.416 1.716 1.00 0.00 H HETATM 46 H UNL 1 1.779 0.566 1.024 1.00 0.00 H HETATM 47 H UNL 1 7.878 2.624 0.451 1.00 0.00 H HETATM 48 H UNL 1 7.654 3.158 -1.227 1.00 0.00 H HETATM 49 H UNL 1 6.627 4.523 1.352 1.00 0.00 H HETATM 50 H UNL 1 6.364 5.154 -0.295 1.00 0.00 H HETATM 51 H UNL 1 8.007 5.038 0.361 1.00 0.00 H HETATM 52 H UNL 1 1.047 3.737 -1.652 1.00 0.00 H HETATM 53 H UNL 1 1.342 3.169 -3.302 1.00 0.00 H HETATM 54 H UNL 1 2.552 4.155 -2.494 1.00 0.00 H HETATM 55 H UNL 1 -1.271 -2.581 -0.569 1.00 0.00 H HETATM 56 H UNL 1 1.095 -1.856 -2.400 1.00 0.00 H HETATM 57 H UNL 1 0.871 -3.391 -1.537 1.00 0.00 H HETATM 58 H UNL 1 -1.239 -1.307 -3.372 1.00 0.00 H HETATM 59 H UNL 1 -2.672 -1.723 -2.424 1.00 0.00 H HETATM 60 H UNL 1 -1.624 -3.007 -3.049 1.00 0.00 H CONECT 1 2 6 7 18 CONECT 2 1 3 9 22 CONECT 3 2 4 21 35 CONECT 4 3 5 10 20 CONECT 5 4 6 14 19 CONECT 6 5 1 16 24 CONECT 7 1 8 25 36 CONECT 8 7 9 17 CONECT 9 8 2 CONECT 10 4 11 37 38 CONECT 11 10 12 39 40 CONECT 12 11 13 41 42 CONECT 13 12 14 43 44 CONECT 14 13 5 15 CONECT 15 14 16 27 26 CONECT 16 15 6 45 46 CONECT 17 8 CONECT 18 1 CONECT 19 5 CONECT 20 4 CONECT 21 23 3 47 48 CONECT 22 2 CONECT 23 21 49 50 51 CONECT 24 6 CONECT 25 7 52 53 54 CONECT 26 28 31 15 32 CONECT 27 15 CONECT 28 26 29 CONECT 29 28 30 34 CONECT 30 29 31 33 55 CONECT 31 30 26 56 57 CONECT 32 26 CONECT 33 30 58 59 60 CONECT 34 29 CONECT 35 3 CONECT 36 7 CONECT 37 10 CONECT 38 10 CONECT 39 11 CONECT 40 11 CONECT 41 12 CONECT 42 12 CONECT 43 13 CONECT 44 13 CONECT 45 16 CONECT 46 16 CONECT 47 21 CONECT 48 21 CONECT 49 23 CONECT 50 23 CONECT 51 23 CONECT 52 25 CONECT 53 25 CONECT 54 25 CONECT 55 30 CONECT 56 31 CONECT 57 31 CONECT 58 33 CONECT 59 33 CONECT 60 33 MASTER 0 0 0 0 0 0 0 0 60 0 60 0 END M END $$$$