HEADER PROTEIN 23-JUN-14 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-JUN-14 0 HETATM 1 C UNK 0 3.192 -4.490 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 9.498 2.300 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 9.269 3.823 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 8.294 1.340 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 7.835 4.385 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 7.441 -1.100 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 2.882 0.942 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 2.651 -3.048 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 6.861 1.902 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 5.999 -0.559 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 6.631 3.425 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 7.372 -2.639 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 2.539 -0.559 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 5.657 0.942 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 5.039 -1.763 0.000 0.00 0.00 C+0 HETATM 16 Br UNK 0 8.576 -3.599 0.000 0.00 0.00 Br+0 HETATM 17 Cl UNK 0 5.198 3.988 0.000 0.00 0.00 Cl+0 HETATM 18 N UNK 0 4.269 1.610 0.000 0.00 0.00 N+0 HETATM 19 N UNK 0 1.166 -2.639 0.000 0.00 0.00 N+0 HETATM 20 N UNK 0 1.097 -1.100 0.000 0.00 0.00 N+0 HETATM 21 N UNK 0 3.499 -1.763 0.000 0.00 0.00 N+0 HETATM 22 S UNK 0 5.887 -3.048 0.000 0.00 0.00 S+0 CONECT 1 8 CONECT 2 3 4 CONECT 3 2 5 CONECT 4 2 9 CONECT 5 3 11 CONECT 6 10 12 CONECT 7 13 18 CONECT 8 1 19 21 CONECT 9 4 11 14 CONECT 10 6 14 15 CONECT 11 5 9 17 CONECT 12 6 16 22 CONECT 13 7 20 21 CONECT 14 9 10 18 CONECT 15 10 21 22 CONECT 16 12 CONECT 17 11 CONECT 18 7 14 CONECT 19 8 20 CONECT 20 13 19 CONECT 21 8 13 15 CONECT 22 12 15 MASTER 0 0 0 0 0 0 0 0 22 0 50 0 END