HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: 507 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 S UNK 0 8.503 1.859 0.000 0.00 0.00 S+0 HETATM 2 O UNK 0 5.748 -2.896 0.000 0.00 0.00 O+0 HETATM 3 O UNK 0 7.081 -0.586 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 4.414 -5.206 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 8.700 5.976 0.000 0.00 0.00 O-1 HETATM 6 O UNK 0 6.542 4.409 0.000 0.00 0.00 O+0 HETATM 7 N UNK 0 9.748 -0.586 0.000 0.00 0.00 N+0 HETATM 8 N UNK 0 10.994 1.859 0.000 0.00 0.00 N+0 HETATM 9 N UNK 0 8.073 4.570 0.000 0.00 0.00 N+1 HETATM 10 C UNK 0 8.415 -2.896 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 7.081 -3.666 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 8.415 -1.356 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 9.748 -3.666 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 7.081 -5.206 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 9.748 -5.206 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 9.748 0.954 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 8.415 -5.976 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 8.978 3.324 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 10.519 3.324 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 4.414 -3.666 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 3.080 -2.896 0.000 0.00 0.00 C+0 CONECT 1 16 18 CONECT 2 11 20 CONECT 3 12 CONECT 4 20 CONECT 5 9 CONECT 6 9 CONECT 7 12 16 CONECT 8 16 19 CONECT 9 5 6 18 CONECT 10 11 12 13 CONECT 11 2 10 14 CONECT 12 3 7 10 CONECT 13 10 15 CONECT 14 11 17 CONECT 15 13 17 CONECT 16 1 7 8 CONECT 17 14 15 CONECT 18 1 9 19 CONECT 19 8 18 CONECT 20 2 4 21 CONECT 21 20 MASTER 0 0 0 0 0 0 0 0 21 0 44 0 END