HEADER PROTEIN 13-JAN-20 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 13-JAN-20 0 HETATM 1 O UNK 0 -2.849 -3.826 0.000 0.00 0.00 O+0 HETATM 2 N UNK 0 -1.940 -2.587 0.000 0.00 0.00 N+0 HETATM 3 C UNK 0 -2.573 -1.183 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -1.665 0.069 0.000 0.00 0.00 C+0 HETATM 5 N UNK 0 -2.133 1.528 0.000 0.00 0.00 N+0 HETATM 6 O UNK 0 -0.894 2.436 0.000 0.00 0.00 O+0 HETATM 7 N UNK 0 0.358 1.528 0.000 0.00 0.00 N+0 HETATM 8 C UNK 0 -0.124 0.069 0.000 0.00 0.00 C+0 HETATM 9 N UNK 0 0.771 -1.183 0.000 0.00 0.00 N+0 HETATM 10 C UNK 0 2.298 -1.018 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 3.206 -2.271 0.000 0.00 0.00 C+0 HETATM 12 N UNK 0 4.734 -2.106 0.000 0.00 0.00 N+0 HETATM 13 S UNK 0 5.642 -3.358 0.000 0.00 0.00 S+0 HETATM 14 N UNK 0 6.537 -4.596 0.000 0.00 0.00 N+0 HETATM 15 O UNK 0 6.881 -2.450 0.000 0.00 0.00 O+0 HETATM 16 O UNK 0 4.390 -4.253 0.000 0.00 0.00 O+0 HETATM 17 N UNK 0 -4.101 -1.018 0.000 0.00 0.00 N+0 HETATM 18 C UNK 0 -4.720 0.385 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 -6.262 0.550 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 -6.881 1.954 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 -5.986 3.193 0.000 0.00 0.00 C+0 HETATM 22 F UNK 0 -6.620 4.596 0.000 0.00 0.00 F+0 HETATM 23 C UNK 0 -4.445 3.041 0.000 0.00 0.00 C+0 HETATM 24 Br UNK 0 -3.550 4.294 0.000 0.00 0.00 Br+0 HETATM 25 C UNK 0 -3.812 1.638 0.000 0.00 0.00 C+0 CONECT 1 2 CONECT 2 1 3 CONECT 3 2 4 17 CONECT 4 3 5 8 CONECT 5 4 6 CONECT 6 5 7 CONECT 7 6 8 CONECT 8 4 7 9 CONECT 9 8 10 CONECT 10 9 11 CONECT 11 10 12 CONECT 12 11 13 CONECT 13 12 14 15 16 CONECT 14 13 CONECT 15 13 CONECT 16 13 CONECT 17 3 18 CONECT 18 17 19 25 CONECT 19 18 20 CONECT 20 19 21 CONECT 21 20 22 23 CONECT 22 21 CONECT 23 21 24 25 CONECT 24 23 CONECT 25 18 23 MASTER 0 0 0 0 0 0 0 0 25 0 52 0 END