D0CV9K AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 -4.277 1.530 0.000 1.00 0.00 C HETATM 2 N UNL 1 -3.563 1.943 0.000 1.00 0.00 N HETATM 3 C UNL 1 -2.848 1.530 0.000 1.00 0.00 C HETATM 4 C UNL 1 -2.134 1.943 0.000 1.00 0.00 C HETATM 5 N UNL 1 -1.419 1.530 0.000 1.00 0.00 N HETATM 6 O UNL 1 -2.134 2.768 0.000 1.00 0.00 O HETATM 7 C UNL 1 -2.848 0.705 0.000 1.00 0.00 C HETATM 8 C UNL 1 -0.705 1.943 0.000 1.00 0.00 C HETATM 9 C UNL 1 -0.705 2.768 0.000 1.00 0.00 C HETATM 10 C UNL 1 0.009 1.530 0.000 1.00 0.00 C HETATM 11 O UNL 1 0.009 0.705 0.000 1.00 0.00 O HETATM 12 N UNL 1 0.724 1.943 0.000 1.00 0.00 N HETATM 13 C UNL 1 1.438 1.530 0.000 1.00 0.00 C HETATM 14 C UNL 1 0.009 3.180 0.000 1.00 0.00 C HETATM 15 C UNL 1 -1.419 3.180 0.000 1.00 0.00 C HETATM 16 C UNL 1 2.051 2.082 0.000 1.00 0.00 C HETATM 17 C UNL 1 1.716 2.836 0.000 1.00 0.00 C HETATM 18 C UNL 1 0.896 2.750 0.000 1.00 0.00 C HETATM 19 C UNL 1 1.774 0.776 0.000 1.00 0.00 C HETATM 20 C UNL 1 2.594 0.863 0.000 1.00 0.00 C HETATM 21 N UNL 1 2.766 1.670 0.000 1.00 0.00 N HETATM 22 H UNL 1 0.825 0.978 0.000 1.00 0.00 H HETATM 23 C UNL 1 1.361 0.062 0.000 1.00 0.00 C HETATM 24 S UNL 1 3.480 2.082 0.000 1.00 0.00 S HETATM 25 O UNL 1 3.480 2.907 0.000 1.00 0.00 O HETATM 26 H UNL 1 2.635 2.666 0.000 1.00 0.00 H HETATM 27 C UNL 1 -0.705 3.593 0.000 1.00 0.00 C HETATM 28 O UNL 1 4.277 2.296 0.000 1.00 0.00 O HETATM 29 C UNL 1 4.195 1.670 0.000 1.00 0.00 C HETATM 30 O UNL 1 0.565 -0.151 0.000 1.00 0.00 O HETATM 31 N UNL 1 1.575 -0.735 0.000 1.00 0.00 N HETATM 32 C UNL 1 1.162 -1.449 0.000 1.00 0.00 C HETATM 33 C UNL 1 0.337 -1.449 0.000 1.00 0.00 C HETATM 34 C UNL 1 -0.075 -2.164 0.000 1.00 0.00 C HETATM 35 C UNL 1 0.337 -2.878 0.000 1.00 0.00 C HETATM 36 C UNL 1 1.162 -2.878 0.000 1.00 0.00 C HETATM 37 C UNL 1 1.575 -2.164 0.000 1.00 0.00 C HETATM 38 C UNL 1 1.575 -3.593 0.000 1.00 0.00 C HETATM 39 C UNL 1 2.400 -3.593 0.000 1.00 0.00 C HETATM 40 C UNL 1 2.812 -2.878 0.000 1.00 0.00 C HETATM 41 N UNL 1 2.400 -2.164 0.000 1.00 0.00 N CONECT 1 2 CONECT 2 1 3 CONECT 3 2 4 7 CONECT 4 3 5 6 CONECT 5 4 8 CONECT 6 4 CONECT 7 3 CONECT 8 5 9 10 CONECT 9 8 14 15 27 CONECT 10 8 11 12 CONECT 11 10 CONECT 12 10 13 18 CONECT 13 12 16 19 22 CONECT 14 9 CONECT 15 9 CONECT 16 13 17 21 26 CONECT 17 16 18 CONECT 18 17 12 CONECT 19 13 20 23 CONECT 20 19 21 CONECT 21 20 16 24 CONECT 22 13 CONECT 23 19 30 31 CONECT 24 21 25 28 29 CONECT 25 24 CONECT 26 16 CONECT 27 9 CONECT 28 24 CONECT 29 24 CONECT 30 23 CONECT 31 23 32 CONECT 32 31 33 37 CONECT 33 32 34 CONECT 34 33 35 CONECT 35 34 36 CONECT 36 35 37 38 CONECT 37 36 32 41 CONECT 38 36 39 CONECT 39 38 40 CONECT 40 39 41 CONECT 41 40 37 MASTER 0 0 0 0 0 0 0 0 41 0 41 0 END M END $$$$