HEADER PROTEIN 19-APR-12 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 19-APR-12 0 HETATM 1 O UNK 0 -1.334 0.770 0.000 0.00 0.00 O+0 HETATM 2 C UNK 0 0.000 0.000 0.000 0.00 0.00 C+0 HETATM 3 O UNK 0 0.000 -1.540 0.000 0.00 0.00 O+0 HETATM 4 C UNK 0 -3.871 -2.500 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 -2.667 -1.540 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -5.373 0.617 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 -3.871 0.960 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 -2.667 0.000 0.000 0.00 0.00 C+0 HETATM 9 N UNK 0 -3.642 -0.223 0.000 0.00 0.00 N+1 HETATM 10 Br UNK 0 -2.328 2.902 0.000 0.00 0.00 Br-1 HETATM 11 C UNK 0 -6.143 -0.716 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 -5.359 -2.102 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 -3.243 1.264 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -2.154 -0.622 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 1.334 0.770 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 1.334 2.310 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 2.667 0.000 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 2.667 3.080 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 2.667 4.620 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 4.001 0.770 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 5.335 0.000 0.000 0.00 0.00 C+0 CONECT 1 8 2 CONECT 2 1 3 15 CONECT 3 2 CONECT 4 5 9 12 CONECT 5 4 8 CONECT 6 7 9 11 CONECT 7 6 8 CONECT 8 1 5 7 CONECT 9 4 6 13 14 CONECT 11 6 12 CONECT 12 4 11 CONECT 13 9 CONECT 14 9 CONECT 15 2 16 17 CONECT 16 15 18 CONECT 17 15 20 CONECT 18 16 19 CONECT 19 18 CONECT 20 17 21 CONECT 21 20 MASTER 0 0 0 0 0 0 0 0 21 0 42 0 END