HEADER PROTEIN 23-JUN-17 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-JUN-17 0 HETATM 1 C UNK 0 -4.232 3.513 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 -2.726 3.192 0.000 0.00 0.00 C+0 HETATM 3 O UNK 0 -2.250 1.728 0.000 0.00 0.00 O+0 HETATM 4 C UNK 0 -0.744 1.408 0.000 0.00 0.00 C+0 HETATM 5 O UNK 0 0.287 2.552 0.000 0.00 0.00 O+0 HETATM 6 C UNK 0 -0.268 -0.057 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 -1.173 -1.303 0.000 0.00 0.00 C+0 HETATM 8 N UNK 0 -0.268 -2.549 0.000 0.00 0.00 N+0 HETATM 9 C UNK 0 1.197 -2.073 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 1.197 -0.533 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 2.530 0.237 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 3.864 -0.533 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 3.864 -2.073 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 2.530 -2.843 0.000 0.00 0.00 C+0 HETATM 15 Br UNK 0 5.198 -2.843 0.000 0.00 0.00 Br+0 HETATM 16 O UNK 0 5.198 0.237 0.000 0.00 0.00 O+0 HETATM 17 C UNK 0 2.530 1.777 0.000 0.00 0.00 C+0 HETATM 18 N UNK 0 3.864 2.547 0.000 0.00 0.00 N+0 HETATM 19 C UNK 0 3.864 4.087 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 5.198 1.777 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 -0.744 -4.013 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 -2.713 -1.303 0.000 0.00 0.00 C+0 HETATM 23 S UNK 0 -3.483 -2.637 0.000 0.00 0.00 S+0 HETATM 24 C UNK 0 -5.023 -2.637 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -5.793 -3.970 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 -7.333 -3.970 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 -8.103 -2.637 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 -7.333 -1.303 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 -5.793 -1.303 0.000 0.00 0.00 C+0 CONECT 1 2 CONECT 2 1 3 CONECT 3 2 4 CONECT 4 3 5 6 CONECT 5 4 CONECT 6 4 7 10 CONECT 7 6 8 22 CONECT 8 7 9 21 CONECT 9 8 10 14 CONECT 10 9 6 11 CONECT 11 10 12 17 CONECT 12 11 13 16 CONECT 13 12 14 15 CONECT 14 13 9 CONECT 15 13 CONECT 16 12 CONECT 17 11 18 CONECT 18 17 19 20 CONECT 19 18 CONECT 20 18 CONECT 21 8 CONECT 22 7 23 CONECT 23 22 24 CONECT 24 23 25 29 CONECT 25 24 26 CONECT 26 25 27 CONECT 27 26 28 CONECT 28 27 29 CONECT 29 28 24 MASTER 0 0 0 0 0 0 0 0 29 0 62 0 END