HEADER PROTEIN 29-APR-22 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 29-APR-22 0 HETATM 1 C UNK 0 2.648 -0.785 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 3.299 0.777 0.000 0.00 0.00 C+0 HETATM 3 S UNK 0 2.626 2.317 0.000 0.00 0.00 S+0 HETATM 4 S UNK 0 1.035 2.856 0.000 0.00 0.00 S+0 HETATM 5 C UNK 0 -0.155 1.673 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -0.214 0.015 0.000 0.00 0.00 C+0 HETATM 7 O UNK 0 -1.640 -0.566 0.000 0.00 0.00 O+0 HETATM 8 N UNK 0 0.990 -1.132 0.000 0.00 0.00 N+0 HETATM 9 O UNK 0 0.567 -2.613 0.000 0.00 0.00 O+0 HETATM 10 C UNK 0 1.639 -3.719 0.000 0.00 0.00 C+0 HETATM 11 N UNK 0 1.323 1.580 0.000 0.00 0.00 N+0 HETATM 12 C UNK 0 1.493 0.147 0.000 0.00 0.00 C+0 HETATM 13 O UNK 0 0.145 -0.598 0.000 0.00 0.00 O+0 HETATM 14 C UNK 0 4.876 0.600 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 5.323 -0.874 0.000 0.00 0.00 C+0 HETATM 16 O UNK 0 3.971 -1.677 0.000 0.00 0.00 O+0 HETATM 17 C UNK 0 6.822 -1.224 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 7.875 -0.100 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 7.429 1.373 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 5.929 1.724 0.000 0.00 0.00 C+0 HETATM 21 Cl UNK 0 8.482 2.497 0.000 0.00 0.00 Cl+0 HETATM 22 O UNK 0 9.375 -0.451 0.000 0.00 0.00 O+0 CONECT 1 2 8 12 16 CONECT 2 1 3 14 CONECT 3 2 4 CONECT 4 3 5 CONECT 5 4 6 11 CONECT 6 5 7 8 CONECT 7 6 CONECT 8 6 1 9 CONECT 9 8 10 CONECT 10 9 CONECT 11 5 12 CONECT 12 11 1 13 CONECT 13 12 CONECT 14 2 15 20 CONECT 15 14 16 17 CONECT 16 15 1 CONECT 17 15 18 CONECT 18 17 19 22 CONECT 19 18 20 21 CONECT 20 19 14 CONECT 21 19 CONECT 22 18 MASTER 0 0 0 0 0 0 0 0 22 0 50 0 END