HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: 559 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 S UNK 0 11.082 2.652 0.000 0.00 0.00 S+0 HETATM 2 O UNK 0 11.852 1.318 0.000 0.00 0.00 O+0 HETATM 3 O UNK 0 10.312 3.986 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 7.081 0.342 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 7.081 -2.738 0.000 0.00 0.00 O+0 HETATM 6 O UNK 0 4.414 1.882 0.000 0.00 0.00 O+0 HETATM 7 O UNK 0 5.748 -6.588 0.000 0.00 0.00 O+0 HETATM 8 N UNK 0 9.748 1.882 0.000 0.00 0.00 N+0 HETATM 9 N UNK 0 11.082 -0.428 0.000 0.00 0.00 N+0 HETATM 10 N UNK 0 9.748 -2.738 0.000 0.00 0.00 N+0 HETATM 11 N UNK 0 13.750 -1.968 0.000 0.00 0.00 N+0 HETATM 12 N UNK 0 12.416 -4.278 0.000 0.00 0.00 N+0 HETATM 13 C UNK 0 16.417 5.732 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 15.083 4.962 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 17.751 6.502 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 15.647 7.066 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 17.187 4.398 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 15.083 3.422 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 13.750 5.732 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 12.416 3.422 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 13.750 2.652 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 12.416 4.962 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 9.748 0.342 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 8.415 -0.428 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 8.415 -1.968 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 11.082 -1.968 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 5.748 -0.428 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 12.416 -2.738 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 7.081 -4.278 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 4.414 0.342 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 5.748 -1.968 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 3.080 -0.428 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 5.748 -5.048 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 4.414 -2.738 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 3.080 -1.968 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 15.083 -2.738 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 13.750 -5.048 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 15.083 -4.278 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 3.080 2.652 0.000 0.00 0.00 C+0 CONECT 1 2 3 8 20 CONECT 2 1 CONECT 3 1 CONECT 4 24 27 CONECT 5 25 29 CONECT 6 30 39 CONECT 7 33 CONECT 8 1 23 CONECT 9 23 26 CONECT 10 25 26 CONECT 11 28 36 CONECT 12 28 37 CONECT 13 14 15 16 17 CONECT 14 13 18 19 CONECT 15 13 CONECT 16 13 CONECT 17 13 CONECT 18 14 21 CONECT 19 14 22 CONECT 20 1 21 22 CONECT 21 18 20 CONECT 22 19 20 CONECT 23 8 9 24 CONECT 24 4 23 25 CONECT 25 5 10 24 CONECT 26 9 10 28 CONECT 27 4 30 31 CONECT 28 11 12 26 CONECT 29 5 33 CONECT 30 6 27 32 CONECT 31 27 34 CONECT 32 30 35 CONECT 33 7 29 CONECT 34 31 35 CONECT 35 32 34 CONECT 36 11 38 CONECT 37 12 38 CONECT 38 36 37 CONECT 39 6 MASTER 0 0 0 0 0 0 0 0 39 0 84 0 END