HEADER PROTEIN 22-OCT-12 NONE TITLE NULL COMPND MOLECULE: Structure #1 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 22-OCT-12 0 HETATM 1 C UNK 0 -9.057 3.227 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 -10.390 3.997 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -10.390 5.537 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -9.057 6.307 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 -7.723 5.537 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -7.723 3.997 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 -6.389 3.227 0.000 0.00 0.00 C+0 HETATM 8 O UNK 0 -6.389 6.307 0.000 0.00 0.00 O+0 HETATM 9 C UNK 0 -5.055 5.537 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 -5.055 3.997 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 -3.722 6.307 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 -2.388 5.537 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 -3.722 7.847 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -2.388 8.617 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -1.054 7.847 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 -1.054 6.307 0.000 0.00 0.00 C+0 HETATM 17 O UNK 0 -11.724 6.307 0.000 0.00 0.00 O+0 HETATM 18 O UNK 0 -9.057 1.687 0.000 0.00 0.00 O+0 HETATM 19 O UNK 0 0.279 8.617 0.000 0.00 0.00 O+0 HETATM 20 C UNK 0 0.272 -0.576 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 0.222 0.963 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 -1.136 1.689 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 -2.444 0.877 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 -2.394 -0.663 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 -1.036 -1.389 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 -0.986 -2.928 0.000 0.00 0.00 C+0 HETATM 27 O UNK 0 -3.702 -1.476 0.000 0.00 0.00 O+0 HETATM 28 C UNK 0 -3.652 -3.015 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 -2.294 -3.741 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 -4.960 -3.828 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 -4.910 -5.367 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 -6.318 -3.101 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 -7.626 -3.914 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 -7.576 -5.453 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 -6.218 -6.179 0.000 0.00 0.00 C+0 HETATM 36 O UNK 0 -1.186 2.911 0.000 0.00 0.00 O+0 HETATM 37 O UNK 0 -8.884 -6.266 0.000 0.00 0.00 O+0 HETATM 38 O UNK 0 2.732 2.907 0.000 0.00 0.00 O+0 HETATM 39 C UNK 0 4.271 2.877 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 5.068 4.194 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 4.325 5.543 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 2.785 5.574 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 1.989 4.256 0.000 0.00 0.00 C+0 HETATM 44 O UNK 0 -0.435 3.970 0.000 0.00 0.00 O+0 HETATM 45 O UNK 0 2.042 6.923 0.000 0.00 0.00 O+0 HETATM 46 O UNK 0 5.122 6.861 0.000 0.00 0.00 O+0 HETATM 47 O UNK 0 6.608 4.163 0.000 0.00 0.00 O+0 HETATM 48 O UNK 0 -2.388 10.157 0.000 0.00 0.00 O+0 HETATM 49 O UNK 0 -2.244 -5.280 0.000 0.00 0.00 O+0 HETATM 50 O UNK 0 -8.984 -3.188 0.000 0.00 0.00 O+0 HETATM 51 O UNK 0 1.630 -1.303 0.000 0.00 0.00 O+0 CONECT 1 2 6 18 CONECT 2 1 3 CONECT 3 2 4 17 CONECT 4 3 5 CONECT 5 4 6 8 CONECT 6 1 5 7 CONECT 7 6 10 23 CONECT 8 5 9 CONECT 9 8 10 11 36 CONECT 10 7 9 44 CONECT 11 9 12 13 CONECT 12 11 16 CONECT 13 11 14 CONECT 14 13 15 48 CONECT 15 14 16 19 CONECT 16 12 15 CONECT 17 3 CONECT 18 1 CONECT 19 15 CONECT 20 21 25 51 CONECT 21 20 22 CONECT 22 21 23 36 CONECT 23 7 22 24 CONECT 24 23 25 27 CONECT 25 20 24 26 CONECT 26 25 29 CONECT 27 24 28 CONECT 28 27 29 30 CONECT 29 26 28 49 CONECT 30 28 31 32 CONECT 31 30 35 CONECT 32 30 33 CONECT 33 32 34 50 CONECT 34 33 35 37 CONECT 35 31 34 CONECT 36 9 22 CONECT 37 34 CONECT 38 39 43 CONECT 39 38 40 CONECT 40 39 41 47 CONECT 41 40 42 46 CONECT 42 41 43 45 CONECT 43 38 42 44 CONECT 44 10 43 CONECT 45 42 CONECT 46 41 CONECT 47 40 CONECT 48 14 CONECT 49 29 CONECT 50 33 CONECT 51 20 MASTER 0 0 0 0 0 0 0 0 51 0 116 0 END