HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: 444 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 S UNK 0 6.677 7.853 0.000 0.00 0.00 S+0 HETATM 2 O UNK 0 6.574 -1.625 0.000 0.00 0.00 O+0 HETATM 3 O UNK 0 11.087 0.031 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 7.908 0.685 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 6.550 4.599 0.000 0.00 0.00 O+0 HETATM 6 O UNK 0 13.217 -1.685 0.000 0.00 0.00 O+0 HETATM 7 O UNK 0 3.907 -0.085 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 9.322 4.610 0.000 0.00 0.00 O+0 HETATM 9 O UNK 0 3.907 2.995 0.000 0.00 0.00 O+0 HETATM 10 O UNK 0 5.312 -7.390 0.000 0.00 0.00 O+0 HETATM 11 O UNK 0 7.548 -8.680 0.000 0.00 0.00 O+0 HETATM 12 O UNK 0 13.243 -8.555 0.000 0.00 0.00 O+0 HETATM 13 O UNK 0 15.910 -3.935 0.000 0.00 0.00 O+0 HETATM 14 O UNK 0 15.910 -7.015 0.000 0.00 0.00 O+0 HETATM 15 C UNK 0 9.242 -1.625 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 10.576 -2.395 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 7.908 -2.395 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 10.576 -3.935 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 7.908 -3.935 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 9.242 -4.705 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 9.564 -0.128 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 11.711 -1.367 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 6.574 -0.085 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 11.909 -4.705 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 5.241 0.685 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 6.574 2.995 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 5.241 2.225 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 7.908 2.225 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 6.507 -4.715 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 9.267 -6.309 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 6.494 -6.320 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 7.884 -7.122 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 9.309 3.006 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 13.243 -3.935 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 11.909 -6.245 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 7.933 5.412 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 13.243 -7.015 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 14.577 -4.705 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 5.962 -8.846 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 14.577 -6.245 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 7.927 6.952 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 9.169 7.862 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 8.688 9.325 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 7.148 9.319 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 11.909 -9.325 0.000 0.00 0.00 C+0 HETATM 46 C UNK 0 17.244 -4.705 0.000 0.00 0.00 C+0 HETATM 47 H UNK 0 8.246 -0.899 0.000 0.00 0.00 H+0 HETATM 48 H UNK 0 11.702 -2.894 0.000 0.00 0.00 H+0 HETATM 49 H UNK 0 5.503 3.603 0.000 0.00 0.00 H+0 HETATM 50 H UNK 0 8.970 1.601 0.000 0.00 0.00 H+0 CONECT 1 41 44 CONECT 2 17 23 CONECT 3 21 22 CONECT 4 23 28 CONECT 5 26 36 CONECT 6 22 CONECT 7 25 CONECT 8 33 36 CONECT 9 27 CONECT 10 31 39 CONECT 11 32 39 CONECT 12 37 45 CONECT 13 38 46 CONECT 14 40 CONECT 15 16 17 21 47 CONECT 16 15 18 22 48 CONECT 17 2 15 19 CONECT 18 16 20 24 CONECT 19 17 20 29 CONECT 20 18 19 30 CONECT 21 3 15 CONECT 22 3 6 16 CONECT 23 2 4 25 CONECT 24 18 34 35 CONECT 25 7 23 27 CONECT 26 5 27 28 49 CONECT 27 9 25 26 CONECT 28 4 26 33 50 CONECT 29 19 31 CONECT 30 20 32 CONECT 31 10 29 32 CONECT 32 11 30 31 CONECT 33 8 28 CONECT 34 24 38 CONECT 35 24 37 CONECT 36 5 8 41 CONECT 37 12 35 40 CONECT 38 13 34 40 CONECT 39 10 11 CONECT 40 14 37 38 CONECT 41 1 36 42 CONECT 42 41 43 CONECT 43 42 44 CONECT 44 1 43 CONECT 45 12 CONECT 46 13 CONECT 47 15 CONECT 48 16 CONECT 49 26 CONECT 50 28 MASTER 0 0 0 0 0 0 0 0 50 0 114 0 END