HEADER PROTEIN 22-APR-16 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 22-APR-16 0 HETATM 1 C UNK 0 -0.677 3.717 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 -2.657 3.717 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -5.668 0.227 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 1.770 -4.453 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 4.001 2.079 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 2.246 -2.988 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 2.495 1.758 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 0.230 -4.453 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 4.771 0.745 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 -1.667 -0.543 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 -0.334 1.767 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 -3.001 1.767 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 -0.334 0.227 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -3.001 0.227 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 1.000 -2.083 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 2.334 0.227 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 1.000 -0.543 0.000 0.00 0.00 C+0 HETATM 18 N UNK 0 -1.667 2.537 0.000 0.00 0.00 N+1 HETATM 19 O UNK 0 -4.335 -0.543 0.000 0.00 0.00 O+0 HETATM 20 S UNK 0 -0.246 -2.988 0.000 0.00 0.00 S+0 HETATM 21 S UNK 0 3.741 -0.399 0.000 0.00 0.00 S+0 HETATM 22 Br UNK 0 9.171 0.000 0.000 0.00 0.00 Br-1 CONECT 1 18 CONECT 2 18 CONECT 3 19 CONECT 4 6 8 CONECT 5 7 9 CONECT 6 4 15 CONECT 7 5 16 CONECT 8 4 20 CONECT 9 5 21 CONECT 10 13 14 CONECT 11 13 18 CONECT 12 14 18 CONECT 13 10 11 17 CONECT 14 10 12 19 CONECT 15 6 17 20 CONECT 16 7 17 21 CONECT 17 13 15 16 CONECT 18 1 2 11 12 CONECT 19 3 14 CONECT 20 8 15 CONECT 21 9 16 MASTER 0 0 0 0 0 0 0 0 22 0 46 0 END