HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: AB3 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 C UNK 0 -0.919 5.081 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 -0.443 3.617 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -1.907 3.141 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 1.022 4.093 0.000 0.00 0.00 C+0 HETATM 5 N UNK 0 0.033 2.152 0.000 0.00 0.00 N+0 HETATM 6 N UNK 0 -0.872 0.906 0.000 0.00 0.00 N+0 HETATM 7 C UNK 0 1.498 1.676 0.000 0.00 0.00 C+0 HETATM 8 N UNK 0 2.832 2.446 0.000 0.00 0.00 N+0 HETATM 9 C UNK 0 4.165 1.676 0.000 0.00 0.00 C+0 HETATM 10 N UNK 0 4.165 0.136 0.000 0.00 0.00 N+0 HETATM 11 C UNK 0 2.832 -0.634 0.000 0.00 0.00 C+0 HETATM 12 N UNK 0 2.832 -2.174 0.000 0.00 0.00 N+0 HETATM 13 C UNK 0 1.498 0.136 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 0.033 -0.340 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.443 -1.804 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 0.588 -2.949 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 -1.949 -2.124 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 -2.425 -3.589 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 -1.394 -4.733 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 0.112 -4.413 0.000 0.00 0.00 C+0 HETATM 21 O UNK 0 1.142 -5.558 0.000 0.00 0.00 O+0 CONECT 1 2 CONECT 2 1 3 4 5 CONECT 3 2 CONECT 4 2 CONECT 5 2 6 7 CONECT 6 5 14 CONECT 7 5 8 13 CONECT 8 7 9 CONECT 9 8 10 CONECT 10 9 11 CONECT 11 10 12 13 CONECT 12 11 CONECT 13 7 11 14 CONECT 14 6 13 15 CONECT 15 14 16 17 CONECT 16 15 20 CONECT 17 15 18 CONECT 18 17 19 CONECT 19 18 20 CONECT 20 16 19 21 CONECT 21 20 MASTER 0 0 0 0 0 0 0 0 21 0 46 0 END