HEADER PROTEIN 07-MAR-20 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 07-MAR-20 0 HETATM 1 C UNK 0 0.669 -4.468 0.000 0.00 0.00 C+0 HETATM 2 N UNK 0 2.003 -3.698 0.000 0.00 0.00 N+0 HETATM 3 C UNK 0 0.669 -1.388 0.000 0.00 0.00 C+0 HETATM 4 C UNK 0 -0.664 -2.158 0.000 0.00 0.00 C+0 HETATM 5 C UNK 0 2.003 -2.158 0.000 0.00 0.00 C+0 HETATM 6 C UNK 0 -0.664 -3.698 0.000 0.00 0.00 C+0 HETATM 7 C UNK 0 0.152 7.209 0.000 0.00 0.00 C+0 HETATM 8 C UNK 0 1.486 6.439 0.000 0.00 0.00 C+0 HETATM 9 N UNK 0 1.486 4.899 0.000 0.00 0.00 N+0 HETATM 10 N UNK 0 -1.181 6.439 0.000 0.00 0.00 N+0 HETATM 11 C UNK 0 3.337 0.151 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 -2.646 4.424 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 -3.551 5.670 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 -2.646 6.915 0.000 0.00 0.00 C+0 HETATM 15 O UNK 0 0.472 2.623 0.000 0.00 0.00 O+0 HETATM 16 O UNK 0 0.153 8.749 0.000 0.00 0.00 O+0 HETATM 17 C UNK 0 2.630 3.868 0.000 0.00 0.00 C+0 HETATM 18 O UNK 0 4.136 4.188 0.000 0.00 0.00 O+0 HETATM 19 C UNK 0 2.003 2.462 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 2.819 7.209 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 4.154 9.518 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 2.820 8.749 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 1.486 9.519 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 4.670 2.461 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 3.337 1.691 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 3.337 -4.468 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 -1.942 -5.981 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 -1.998 -4.468 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 -3.161 -6.870 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 -3.390 -3.789 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 0.680 -6.010 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 -4.554 -6.192 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 -4.670 -4.651 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 -0.659 -6.785 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 -1.090 -8.275 0.000 0.00 0.00 C+0 HETATM 36 Br UNK 0 -0.182 -9.519 0.000 0.00 0.00 Br+0 HETATM 37 N UNK 0 -2.634 -8.326 0.000 0.00 0.00 N+0 HETATM 38 H UNK 0 2.003 -5.238 0.000 0.00 0.00 H+0 HETATM 39 C UNK 0 0.669 0.152 0.000 0.00 0.00 C+0 HETATM 40 N UNK 0 2.003 0.922 0.000 0.00 0.00 N+0 HETATM 41 O UNK 0 -0.664 0.922 0.000 0.00 0.00 O+0 HETATM 42 C UNK 0 -1.182 4.899 0.000 0.00 0.00 C+0 HETATM 43 H UNK 0 -1.182 3.359 0.000 0.00 0.00 H+0 HETATM 44 C UNK 0 0.152 4.129 0.000 0.00 0.00 C+0 HETATM 45 O UNK 0 0.152 5.669 0.000 0.00 0.00 O+0 CONECT 1 31 38 2 6 CONECT 2 1 26 5 CONECT 3 39 4 5 CONECT 4 3 6 CONECT 5 3 2 CONECT 6 1 4 28 CONECT 7 16 8 10 CONECT 8 7 9 20 CONECT 9 8 17 44 CONECT 10 7 14 42 CONECT 11 25 CONECT 12 42 13 CONECT 13 12 14 CONECT 14 10 13 CONECT 15 44 19 CONECT 16 7 CONECT 17 9 19 18 CONECT 18 17 CONECT 19 15 17 25 40 CONECT 20 8 22 CONECT 21 22 CONECT 22 20 21 23 CONECT 23 22 CONECT 24 25 CONECT 25 11 19 24 CONECT 26 2 CONECT 27 28 34 29 CONECT 28 6 27 30 CONECT 29 27 37 32 CONECT 30 28 33 CONECT 31 1 34 CONECT 32 29 33 CONECT 33 30 32 CONECT 34 27 31 35 CONECT 35 34 37 36 CONECT 36 35 CONECT 37 29 35 CONECT 38 1 CONECT 39 3 41 40 CONECT 40 19 39 CONECT 41 39 CONECT 42 10 12 44 43 CONECT 43 42 CONECT 44 9 15 42 45 CONECT 45 44 MASTER 0 0 0 0 0 0 0 0 45 0 102 0 END