HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: 1347 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 Br UNK 0 15.726 3.881 0.000 0.00 0.00 Br+0 HETATM 2 S UNK 0 18.457 -2.823 0.000 0.00 0.00 S+0 HETATM 3 F UNK 0 20.561 -3.387 0.000 0.00 0.00 F+0 HETATM 4 F UNK 0 17.893 -4.927 0.000 0.00 0.00 F+0 HETATM 5 F UNK 0 19.997 -5.491 0.000 0.00 0.00 F+0 HETATM 6 O UNK 0 7.873 5.111 0.000 0.00 0.00 O+0 HETATM 7 O UNK 0 15.248 -0.061 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 19.791 -2.053 0.000 0.00 0.00 O+0 HETATM 9 O UNK 0 17.123 -3.593 0.000 0.00 0.00 O+0 HETATM 10 N UNK 0 8.456 1.948 0.000 0.00 0.00 N+0 HETATM 11 N UNK 0 6.789 0.096 0.000 0.00 0.00 N+0 HETATM 12 N UNK 0 5.264 4.557 0.000 0.00 0.00 N+0 HETATM 13 N UNK 0 17.687 -1.490 0.000 0.00 0.00 N+0 HETATM 14 C UNK 0 4.487 1.591 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 3.080 0.965 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 3.241 2.496 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 6.019 1.430 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 7.049 2.574 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 8.295 0.416 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 9.790 2.718 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 9.440 -0.614 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 6.729 4.081 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 11.123 1.948 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 9.119 -2.121 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 12.457 2.718 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 11.123 0.408 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 13.791 1.948 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 13.791 0.408 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 12.457 -0.362 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 15.248 2.417 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 16.147 1.178 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 17.687 1.178 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 18.457 -0.156 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 18.457 2.512 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 19.997 -0.156 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 19.997 2.512 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 20.767 1.178 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 19.227 -4.157 0.000 0.00 0.00 C+0 CONECT 1 30 CONECT 2 8 9 13 38 CONECT 3 38 CONECT 4 38 CONECT 5 38 CONECT 6 22 CONECT 7 28 31 CONECT 8 2 CONECT 9 2 CONECT 10 18 19 20 CONECT 11 17 19 CONECT 12 22 CONECT 13 2 33 CONECT 14 15 16 17 CONECT 15 14 16 CONECT 16 14 15 CONECT 17 11 14 18 CONECT 18 10 17 22 CONECT 19 10 11 21 CONECT 20 10 23 CONECT 21 19 24 CONECT 22 6 12 18 CONECT 23 20 25 26 CONECT 24 21 CONECT 25 23 27 CONECT 26 23 29 CONECT 27 25 28 30 CONECT 28 7 27 29 CONECT 29 26 28 CONECT 30 1 27 31 CONECT 31 7 30 32 CONECT 32 31 33 34 CONECT 33 13 32 35 CONECT 34 32 36 CONECT 35 33 37 CONECT 36 34 37 CONECT 37 35 36 CONECT 38 2 3 4 5 MASTER 0 0 0 0 0 0 0 0 38 0 84 0 END