HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: 1200 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 Br UNK 0 14.543 -6.018 0.000 0.00 0.00 Br+0 HETATM 2 O UNK 0 4.559 3.271 0.000 0.00 0.00 O+0 HETATM 3 O UNK 0 3.641 4.829 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 8.434 2.398 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 7.874 8.422 0.000 0.00 0.00 O+0 HETATM 6 O UNK 0 5.152 -1.394 0.000 0.00 0.00 O+0 HETATM 7 N UNK 0 6.705 4.519 0.000 0.00 0.00 N+0 HETATM 8 N UNK 0 5.442 7.328 0.000 0.00 0.00 N+0 HETATM 9 N UNK 0 6.477 0.922 0.000 0.00 0.00 N+0 HETATM 10 N UNK 0 10.592 -1.394 0.000 0.00 0.00 N+0 HETATM 11 N UNK 0 12.412 -7.733 0.000 0.00 0.00 N+0 HETATM 12 C UNK 0 4.541 6.078 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 5.173 4.674 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 7.606 5.768 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 3.085 6.549 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 5.702 2.252 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 4.534 8.560 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 3.080 8.080 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 7.025 3.022 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 6.974 7.172 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 9.138 5.613 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 4.676 1.104 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 10.038 6.862 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 5.157 -0.359 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 3.168 1.418 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 6.483 -0.618 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 7.820 -1.383 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 10.567 -2.998 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 9.209 -0.581 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 11.570 6.707 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 9.406 8.267 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 9.233 -3.768 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 7.832 -2.987 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 11.901 -3.768 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 9.233 -5.308 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 11.901 -5.308 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 10.567 -6.078 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 11.934 -0.640 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 10.592 -7.682 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 13.036 -6.335 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 7.832 -6.089 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 9.209 -8.495 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 7.820 -7.693 0.000 0.00 0.00 C+0 HETATM 44 H UNK 0 3.719 5.160 0.000 0.00 0.00 H+0 HETATM 45 H UNK 0 11.639 -2.390 0.000 0.00 0.00 H+0 CONECT 1 40 CONECT 2 13 16 CONECT 3 13 CONECT 4 19 CONECT 5 20 CONECT 6 26 CONECT 7 13 14 19 CONECT 8 12 17 20 CONECT 9 16 26 CONECT 10 28 29 38 CONECT 11 39 40 CONECT 12 8 13 15 44 CONECT 13 2 3 7 12 CONECT 14 7 20 21 CONECT 15 12 18 CONECT 16 2 9 19 22 CONECT 17 8 18 CONECT 18 15 17 CONECT 19 4 7 16 CONECT 20 5 8 14 CONECT 21 14 23 CONECT 22 16 24 25 CONECT 23 21 30 31 CONECT 24 22 CONECT 25 22 CONECT 26 6 9 27 CONECT 27 26 29 33 CONECT 28 10 32 34 45 CONECT 29 10 27 CONECT 30 23 CONECT 31 23 CONECT 32 28 33 35 CONECT 33 27 32 CONECT 34 28 36 CONECT 35 32 37 41 CONECT 36 34 37 40 CONECT 37 35 36 39 CONECT 38 10 CONECT 39 11 37 42 CONECT 40 1 11 36 CONECT 41 35 43 CONECT 42 39 43 CONECT 43 41 42 CONECT 44 12 CONECT 45 28 MASTER 0 0 0 0 0 0 0 0 45 0 102 0 END