HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: Structure #1 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 C UNK 0 3.250 -3.025 0.000 0.00 0.00 C+0 HETATM 2 C UNK 0 -2.667 0.000 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 8.341 -0.483 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 0.539 -4.995 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 1.873 -5.765 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 4.372 -1.407 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 2.215 0.161 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 1.785 -2.549 0.000 0.00 0.00 C+0 HETATM 9 C UNK 0 -1.136 0.161 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 6.809 -0.322 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 3.746 0.000 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 0.539 -3.455 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 4.651 1.246 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -0.231 -1.085 0.000 0.00 0.00 C+0 HETATM 15 N UNK 0 4.025 2.653 0.000 0.00 0.00 N+0 HETATM 16 N UNK 0 5.904 -1.568 0.000 0.00 0.00 N+0 HETATM 17 N UNK 0 6.183 1.085 0.000 0.00 0.00 N+0 HETATM 18 N UNK 0 1.309 -1.085 0.000 0.00 0.00 N+1 HETATM 19 O UNK 0 -0.509 1.568 0.000 0.00 0.00 O+0 HETATM 20 O UNK 0 8.541 -4.995 0.000 0.00 0.00 O+0 HETATM 21 O UNK 0 7.978 -7.098 0.000 0.00 0.00 O+0 HETATM 22 O UNK 0 6.438 -4.431 0.000 0.00 0.00 O+0 HETATM 23 O UNK 0 3.770 -7.098 0.000 0.00 0.00 O+0 HETATM 24 O UNK 0 5.310 -4.431 0.000 0.00 0.00 O+0 HETATM 25 O UNK 0 3.207 -4.995 0.000 0.00 0.00 O+0 HETATM 26 O UNK 0 5.874 -6.535 0.000 0.00 0.00 O+0 HETATM 27 P UNK 0 7.208 -5.765 0.000 0.00 0.00 P+0 HETATM 28 P UNK 0 4.540 -5.765 0.000 0.00 0.00 P+0 HETATM 29 S UNK 0 -0.707 -2.549 0.000 0.00 0.00 S+0 CONECT 1 8 CONECT 2 9 CONECT 3 10 CONECT 4 5 12 CONECT 5 4 25 CONECT 6 11 16 CONECT 7 11 18 CONECT 8 1 12 18 CONECT 9 2 14 19 CONECT 10 3 16 17 CONECT 11 6 7 13 CONECT 12 4 8 29 CONECT 13 11 15 17 CONECT 14 9 18 29 CONECT 15 13 CONECT 16 6 10 CONECT 17 10 13 CONECT 18 7 8 14 CONECT 19 9 CONECT 20 27 CONECT 21 27 CONECT 22 27 CONECT 23 28 CONECT 24 28 CONECT 25 5 28 CONECT 26 27 28 CONECT 27 20 21 22 26 CONECT 28 23 24 25 26 CONECT 29 12 14 MASTER 0 0 0 0 0 0 0 0 29 0 60 0 END