HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: 1413 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 S UNK 0 8.749 -0.499 0.000 0.00 0.00 S+0 HETATM 2 S UNK 0 19.273 -1.262 0.000 0.00 0.00 S+0 HETATM 3 O UNK 0 12.722 2.909 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 10.082 4.891 0.000 0.00 0.00 O-1 HETATM 5 O UNK 0 7.415 4.891 0.000 0.00 0.00 O+0 HETATM 6 O UNK 0 14.612 1.056 0.000 0.00 0.00 O+0 HETATM 7 O UNK 0 13.407 -3.404 0.000 0.00 0.00 O+0 HETATM 8 N UNK 0 4.747 1.811 0.000 0.00 0.00 N+1 HETATM 9 N UNK 0 10.082 1.811 0.000 0.00 0.00 N+0 HETATM 10 N UNK 0 12.722 -0.827 0.000 0.00 0.00 N+0 HETATM 11 N UNK 0 14.895 -3.009 0.000 0.00 0.00 N+0 HETATM 12 N UNK 0 17.340 0.310 0.000 0.00 0.00 N+0 HETATM 13 N UNK 0 19.850 1.421 0.000 0.00 0.00 N+0 HETATM 14 C UNK 0 5.517 0.477 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 3.241 1.491 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 6.081 2.581 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 4.487 -0.667 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 3.080 -0.041 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 4.427 3.318 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 7.415 1.811 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 10.082 0.271 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 11.635 0.265 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 8.749 2.581 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 7.415 0.271 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 11.635 1.818 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 8.749 4.121 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 14.210 -0.431 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 15.297 -1.522 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 16.785 -1.127 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 17.980 -2.098 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 18.878 0.226 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 13.005 -4.891 0.000 0.00 0.00 C+0 HETATM 33 H UNK 0 10.399 -0.920 0.000 0.00 0.00 H+0 CONECT 1 21 24 CONECT 2 30 31 CONECT 3 25 CONECT 4 26 CONECT 5 26 CONECT 6 27 CONECT 7 11 32 CONECT 8 14 15 16 19 CONECT 9 21 23 25 CONECT 10 22 27 CONECT 11 7 28 CONECT 12 29 31 CONECT 13 31 CONECT 14 8 17 CONECT 15 8 18 CONECT 16 8 20 CONECT 17 14 18 CONECT 18 15 17 CONECT 19 8 CONECT 20 16 23 24 CONECT 21 1 9 22 33 CONECT 22 10 21 25 CONECT 23 9 20 26 CONECT 24 1 20 CONECT 25 3 9 22 CONECT 26 4 5 23 CONECT 27 6 10 28 CONECT 28 11 27 29 CONECT 29 12 28 30 CONECT 30 2 29 CONECT 31 2 12 13 CONECT 32 7 CONECT 33 21 MASTER 0 0 0 0 0 0 0 0 33 0 72 0 END