D0QR1Z AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 1.752 -0.091 -0.170 1.00 0.00 C HETATM 2 C UNL 1 0.884 0.907 0.197 1.00 0.00 C HETATM 3 N UNL 1 1.263 2.166 0.480 1.00 0.00 N HETATM 4 C UNL 1 2.577 2.424 0.414 1.00 0.00 C HETATM 5 N UNL 1 3.498 1.505 0.054 1.00 0.00 N HETATM 6 C UNL 1 3.076 0.266 -0.252 1.00 0.00 C HETATM 7 C UNL 1 4.112 -0.707 -0.613 1.00 0.00 C HETATM 8 N UNL 1 5.313 -0.488 -1.290 1.00 0.00 N HETATM 9 C UNL 1 6.020 -1.691 -1.263 1.00 0.00 C HETATM 10 N UNL 1 5.242 -2.672 -0.858 1.00 0.00 N HETATM 11 C UNL 1 4.073 -2.086 -0.486 1.00 0.00 C HETATM 12 C UNL 1 7.441 -1.897 -1.660 1.00 0.00 C HETATM 13 C UNL 1 5.592 0.587 -2.249 1.00 0.00 C HETATM 14 C UNL 1 4.469 0.707 -3.288 1.00 0.00 C HETATM 15 C UNL 1 5.973 1.944 -1.657 1.00 0.00 C HETATM 16 N UNL 1 3.113 3.679 0.698 1.00 0.00 N HETATM 17 C UNL 1 2.577 4.880 0.976 1.00 0.00 C HETATM 18 C UNL 1 1.273 5.314 1.140 1.00 0.00 C HETATM 19 C UNL 1 1.189 6.724 1.406 1.00 0.00 C HETATM 20 C UNL 1 2.427 7.336 1.438 1.00 0.00 C HETATM 21 S UNL 1 3.670 6.191 1.171 1.00 0.00 S HETATM 22 C UNL 1 2.730 8.745 1.660 1.00 0.00 C HETATM 23 O UNL 1 1.877 9.614 1.845 1.00 0.00 O HETATM 24 N UNL 1 4.067 9.080 1.635 1.00 0.00 N HETATM 25 O UNL 1 4.424 10.439 1.751 1.00 0.00 O HETATM 26 H UNL 1 1.401 -1.092 -0.381 1.00 0.00 H HETATM 27 H UNL 1 -0.183 0.713 0.277 1.00 0.00 H HETATM 28 H UNL 1 3.255 -2.694 -0.123 1.00 0.00 H HETATM 29 H UNL 1 7.726 -1.369 -2.571 1.00 0.00 H HETATM 30 H UNL 1 7.620 -2.963 -1.844 1.00 0.00 H HETATM 31 H UNL 1 8.108 -1.591 -0.847 1.00 0.00 H HETATM 32 H UNL 1 6.475 0.257 -2.806 1.00 0.00 H HETATM 33 H UNL 1 3.735 1.468 -3.006 1.00 0.00 H HETATM 34 H UNL 1 3.932 -0.240 -3.421 1.00 0.00 H HETATM 35 H UNL 1 4.882 0.986 -4.262 1.00 0.00 H HETATM 36 H UNL 1 5.101 2.547 -1.398 1.00 0.00 H HETATM 37 H UNL 1 6.523 2.531 -2.402 1.00 0.00 H HETATM 38 H UNL 1 6.605 1.845 -0.769 1.00 0.00 H HETATM 39 H UNL 1 4.120 3.603 0.612 1.00 0.00 H HETATM 40 H UNL 1 0.409 4.664 1.069 1.00 0.00 H HETATM 41 H UNL 1 0.260 7.265 1.560 1.00 0.00 H HETATM 42 H UNL 1 4.800 8.420 1.401 1.00 0.00 H HETATM 43 H UNL 1 3.551 10.880 1.846 1.00 0.00 H CONECT 1 2 6 26 CONECT 2 1 3 27 CONECT 3 2 4 CONECT 4 3 5 16 CONECT 5 4 6 CONECT 6 5 1 7 CONECT 7 6 8 11 CONECT 8 7 9 13 CONECT 9 8 10 12 CONECT 10 9 11 CONECT 11 10 7 28 CONECT 12 9 29 30 31 CONECT 13 8 14 15 32 CONECT 14 13 33 34 35 CONECT 15 13 36 37 38 CONECT 16 4 17 39 CONECT 17 16 18 21 CONECT 18 17 19 40 CONECT 19 18 20 41 CONECT 20 19 21 22 CONECT 21 20 17 CONECT 22 20 23 24 CONECT 23 22 CONECT 24 22 25 42 CONECT 25 24 43 CONECT 26 1 CONECT 27 2 CONECT 28 11 CONECT 29 12 CONECT 30 12 CONECT 31 12 CONECT 32 13 CONECT 33 14 CONECT 34 14 CONECT 35 14 CONECT 36 15 CONECT 37 15 CONECT 38 15 CONECT 39 16 CONECT 40 18 CONECT 41 19 CONECT 42 24 CONECT 43 25 MASTER 0 0 0 0 0 0 0 0 43 0 43 0 END M END $$$$