HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: 528 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 O UNK 0 15.083 -1.833 0.000 0.00 0.00 O+0 HETATM 2 O UNK 0 16.417 0.477 0.000 0.00 0.00 O+0 HETATM 3 O UNK 0 23.086 -1.833 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 21.752 0.477 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 21.752 5.097 0.000 0.00 0.00 O-1 HETATM 6 O UNK 0 23.086 2.787 0.000 0.00 0.00 O+0 HETATM 7 N UNK 0 11.082 -1.063 0.000 0.00 0.00 N+0 HETATM 8 N UNK 0 19.085 -4.143 0.000 0.00 0.00 N+0 HETATM 9 N UNK 0 21.752 3.557 0.000 0.00 0.00 N+1 HETATM 10 C UNK 0 13.750 -1.063 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 12.416 -0.293 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 9.748 -0.293 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 8.415 -1.063 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 7.081 -0.293 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 19.085 -1.063 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 14.520 0.271 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 12.980 -2.396 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 17.751 -1.833 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 11.082 -2.603 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 5.748 -1.063 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 7.081 1.247 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 20.418 -1.833 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 16.417 -1.063 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 17.751 -3.373 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 19.085 0.477 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 20.418 -3.373 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 5.748 -2.603 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 5.748 2.017 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 4.414 -0.293 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 8.415 2.017 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 16.417 -4.143 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 20.418 1.247 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 17.751 1.247 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 21.752 -1.063 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 21.752 -4.143 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 20.418 2.787 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 4.414 -3.373 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 5.748 3.557 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 3.080 -1.063 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 8.415 3.557 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 17.751 2.787 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 3.080 -2.603 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 7.081 4.327 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 19.085 3.557 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 24.419 -1.063 0.000 0.00 0.00 C+0 CONECT 1 10 23 CONECT 2 23 CONECT 3 34 45 CONECT 4 34 CONECT 5 9 CONECT 6 9 CONECT 7 11 12 19 CONECT 8 24 26 CONECT 9 5 6 36 CONECT 10 1 11 16 17 CONECT 11 7 10 CONECT 12 7 13 CONECT 13 12 14 CONECT 14 13 20 21 CONECT 15 18 22 25 CONECT 16 10 CONECT 17 10 CONECT 18 15 23 24 CONECT 19 7 CONECT 20 14 27 29 CONECT 21 14 28 30 CONECT 22 15 26 34 CONECT 23 1 2 18 CONECT 24 8 18 31 CONECT 25 15 32 33 CONECT 26 8 22 35 CONECT 27 20 37 CONECT 28 21 38 CONECT 29 20 39 CONECT 30 21 40 CONECT 31 24 CONECT 32 25 36 CONECT 33 25 41 CONECT 34 3 4 22 CONECT 35 26 CONECT 36 9 32 44 CONECT 37 27 42 CONECT 38 28 43 CONECT 39 29 42 CONECT 40 30 43 CONECT 41 33 44 CONECT 42 37 39 CONECT 43 38 40 CONECT 44 36 41 CONECT 45 3 MASTER 0 0 0 0 0 0 0 0 45 0 96 0 END