HEADER PROTEIN 23-FEB-12 NONE TITLE NULL COMPND MOLECULE: 1329 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 23-FEB-12 0 HETATM 1 S UNK 0 10.852 2.147 0.000 0.00 0.00 S+0 HETATM 2 S UNK 0 6.851 4.457 0.000 0.00 0.00 S+0 HETATM 3 O UNK 0 14.825 5.555 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 16.715 3.702 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 9.519 7.537 0.000 0.00 0.00 O+0 HETATM 6 O UNK 0 12.186 7.537 0.000 0.00 0.00 O+0 HETATM 7 O UNK 0 19.574 -1.058 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 15.109 -2.245 0.000 0.00 0.00 O+0 HETATM 9 O UNK 0 14.305 -5.218 0.000 0.00 0.00 O+0 HETATM 10 O UNK 0 23.354 2.706 0.000 0.00 0.00 O+0 HETATM 11 N UNK 0 12.186 4.457 0.000 0.00 0.00 N+0 HETATM 12 N UNK 0 14.825 1.819 0.000 0.00 0.00 N+0 HETATM 13 N UNK 0 16.999 -0.363 0.000 0.00 0.00 N+0 HETATM 14 N UNK 0 17.684 -2.941 0.000 0.00 0.00 N+0 HETATM 15 N UNK 0 16.880 -5.914 0.000 0.00 0.00 N+0 HETATM 16 N UNK 0 4.110 4.601 0.000 0.00 0.00 N+0 HETATM 17 N UNK 0 5.356 6.759 0.000 0.00 0.00 N+0 HETATM 18 N UNK 0 3.080 5.745 0.000 0.00 0.00 N+0 HETATM 19 N UNK 0 3.850 7.079 0.000 0.00 0.00 N+0 HETATM 20 C UNK 0 12.186 2.917 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 13.739 2.911 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 13.739 4.464 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 10.852 5.227 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 9.519 4.457 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 9.519 2.917 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 16.314 2.215 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 8.185 5.227 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 17.400 1.124 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 10.852 6.767 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 18.889 1.519 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 18.085 -1.454 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 18.770 -4.032 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 18.369 -5.519 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 19.290 3.006 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 19.976 0.428 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 16.195 -3.336 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 15.794 -4.823 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 5.517 5.227 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 16.479 -7.401 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 20.779 3.402 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 21.464 0.824 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 21.865 2.311 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 17.566 -8.492 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 3.790 3.095 0.000 0.00 0.00 C+0 HETATM 45 H UNK 0 12.502 1.726 0.000 0.00 0.00 H+0 CONECT 1 20 25 CONECT 2 27 38 CONECT 3 22 CONECT 4 26 CONECT 5 29 CONECT 6 29 CONECT 7 31 CONECT 8 36 CONECT 9 37 CONECT 10 42 CONECT 11 20 22 23 CONECT 12 21 26 CONECT 13 28 31 CONECT 14 31 32 36 CONECT 15 33 37 39 CONECT 16 18 38 44 CONECT 17 19 38 CONECT 18 16 19 CONECT 19 17 18 CONECT 20 1 11 21 45 CONECT 21 12 20 22 CONECT 22 3 11 21 CONECT 23 11 24 29 CONECT 24 23 25 27 CONECT 25 1 24 CONECT 26 4 12 28 CONECT 27 2 24 CONECT 28 13 26 30 CONECT 29 5 6 23 CONECT 30 28 34 35 CONECT 31 7 13 14 CONECT 32 14 33 CONECT 33 15 32 CONECT 34 30 40 CONECT 35 30 41 CONECT 36 8 14 37 CONECT 37 9 15 36 CONECT 38 2 16 17 CONECT 39 15 43 CONECT 40 34 42 CONECT 41 35 42 CONECT 42 10 40 41 CONECT 43 39 CONECT 44 16 CONECT 45 20 MASTER 0 0 0 0 0 0 0 0 45 0 98 0 END