HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: B1L SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 O UNK 0 -2.691 6.498 0.000 0.00 0.00 O+0 HETATM 2 C UNK 0 -2.691 4.958 0.000 0.00 0.00 C+0 HETATM 3 C UNK 0 -1.357 4.188 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -1.357 2.648 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 -2.691 1.878 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -4.024 2.648 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 -4.024 4.188 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 -2.691 0.338 0.000 0.00 0.00 C+0 HETATM 9 O UNK 0 -4.024 -0.432 0.000 0.00 0.00 O+0 HETATM 10 N UNK 0 -1.357 -0.432 0.000 0.00 0.00 N+0 HETATM 11 C UNK 0 -1.357 -1.972 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 0.031 -2.641 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 0.373 -4.142 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -0.587 -5.346 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 -2.127 -5.346 0.000 0.00 0.00 C+0 HETATM 16 N UNK 0 -3.087 -4.142 0.000 0.00 0.00 N+0 HETATM 17 C UNK 0 -2.744 -2.641 0.000 0.00 0.00 C+0 HETATM 18 O UNK 0 1.235 -1.680 0.000 0.00 0.00 O+0 HETATM 19 C UNK 0 1.005 -0.158 0.000 0.00 0.00 C+0 HETATM 20 O UNK 0 -0.428 0.405 0.000 0.00 0.00 O+0 HETATM 21 C UNK 0 2.209 0.803 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 1.980 2.325 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 3.184 3.286 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 4.617 2.723 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 4.847 1.200 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 3.643 0.240 0.000 0.00 0.00 C+0 HETATM 27 O UNK 0 5.821 3.683 0.000 0.00 0.00 O+0 HETATM 28 H UNK 0 -0.688 -1.112 0.000 0.00 0.00 H+0 HETATM 29 H UNK 0 0.286 -1.581 0.000 0.00 0.00 H+0 CONECT 1 2 CONECT 2 1 3 7 CONECT 3 2 4 CONECT 4 3 5 CONECT 5 4 6 8 CONECT 6 5 7 CONECT 7 2 6 CONECT 8 5 9 10 CONECT 9 8 CONECT 10 8 11 CONECT 11 10 12 17 28 CONECT 12 11 13 18 29 CONECT 13 12 14 CONECT 14 13 15 CONECT 15 14 16 CONECT 16 15 17 CONECT 17 11 16 CONECT 18 12 19 CONECT 19 18 20 21 CONECT 20 19 CONECT 21 19 22 26 CONECT 22 21 23 CONECT 23 22 24 CONECT 24 23 25 27 CONECT 25 24 26 CONECT 26 21 25 CONECT 27 24 CONECT 28 11 CONECT 29 12 MASTER 0 0 0 0 0 0 0 0 29 0 62 0 END