HEADER PROTEIN 19-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 19-JUN-21 0 HETATM 1 O UNK 0 -3.016 -2.351 -2.810 0.00 0.00 O+0 HETATM 2 C UNK 0 -4.002 -1.332 -3.029 0.00 0.00 C+0 HETATM 3 C UNK 0 -4.487 -0.748 -1.692 0.00 0.00 C+0 HETATM 4 O UNK 0 -4.928 -1.814 -0.852 0.00 0.00 O+0 HETATM 5 C UNK 0 -3.415 -0.015 -1.009 0.00 0.00 C+0 HETATM 6 C UNK 0 -2.517 0.567 -0.463 0.00 0.00 C+0 HETATM 7 C UNK 0 -1.328 1.277 0.206 0.00 0.00 C+0 HETATM 8 C UNK 0 -0.366 1.795 0.701 0.00 0.00 C+0 HETATM 9 C UNK 0 0.848 2.391 1.275 0.00 0.00 C+0 HETATM 10 C UNK 0 1.672 1.380 2.078 0.00 0.00 C+0 HETATM 11 C UNK 0 2.104 0.120 1.314 0.00 0.00 C+0 HETATM 12 C UNK 0 2.928 0.415 0.059 0.00 0.00 C+0 HETATM 13 C UNK 0 3.455 -0.848 -0.635 0.00 0.00 C+0 HETATM 14 C UNK 0 2.384 -1.830 -1.118 0.00 0.00 C+0 HETATM 15 C UNK 0 1.472 -1.228 -2.102 0.00 0.00 C+0 HETATM 16 C UNK 0 0.726 -0.726 -2.897 0.00 0.00 C+0 HETATM 17 C UNK 0 -0.155 -0.118 -3.830 0.00 0.00 C+0 HETATM 18 C UNK 0 -0.565 1.144 -3.669 0.00 0.00 C+0 HETATM 19 Br UNK 0 -1.722 2.017 -4.826 0.00 0.00 Br+0 HETATM 20 H UNK 0 -2.214 -1.907 -2.474 0.00 0.00 H+0 HETATM 21 H UNK 0 -4.837 -1.817 -3.544 0.00 0.00 H+0 HETATM 22 H UNK 0 -3.582 -0.567 -3.689 0.00 0.00 H+0 HETATM 23 H UNK 0 -5.338 -0.083 -1.869 0.00 0.00 H+0 HETATM 24 H UNK 0 -4.301 -2.546 -1.010 0.00 0.00 H+0 HETATM 25 H UNK 0 1.460 2.829 0.479 0.00 0.00 H+0 HETATM 26 H UNK 0 0.566 3.219 1.936 0.00 0.00 H+0 HETATM 27 H UNK 0 2.565 1.888 2.463 0.00 0.00 H+0 HETATM 28 H UNK 0 1.093 1.063 2.955 0.00 0.00 H+0 HETATM 29 H UNK 0 2.697 -0.505 1.994 0.00 0.00 H+0 HETATM 30 H UNK 0 1.215 -0.464 1.055 0.00 0.00 H+0 HETATM 31 H UNK 0 3.788 1.039 0.335 0.00 0.00 H+0 HETATM 32 H UNK 0 2.338 0.999 -0.656 0.00 0.00 H+0 HETATM 33 H UNK 0 4.127 -1.377 0.053 0.00 0.00 H+0 HETATM 34 H UNK 0 4.070 -0.537 -1.490 0.00 0.00 H+0 HETATM 35 H UNK 0 1.813 -2.223 -0.270 0.00 0.00 H+0 HETATM 36 H UNK 0 2.883 -2.692 -1.576 0.00 0.00 H+0 HETATM 37 H UNK 0 -0.485 -0.710 -4.678 0.00 0.00 H+0 HETATM 38 H UNK 0 -0.250 1.760 -2.834 0.00 0.00 H+0 CONECT 1 2 20 CONECT 2 3 1 21 22 CONECT 3 5 2 4 23 CONECT 4 3 24 CONECT 5 6 3 CONECT 6 7 5 CONECT 7 8 6 CONECT 8 7 9 CONECT 9 10 8 25 26 CONECT 10 11 9 27 28 CONECT 11 12 10 29 30 CONECT 12 13 11 31 32 CONECT 13 12 14 33 34 CONECT 14 15 13 35 36 CONECT 15 16 14 CONECT 16 15 17 CONECT 17 16 18 37 CONECT 18 17 19 38 CONECT 19 18 CONECT 20 1 CONECT 21 2 CONECT 22 2 CONECT 23 3 CONECT 24 4 CONECT 25 9 CONECT 26 9 CONECT 27 10 CONECT 28 10 CONECT 29 11 CONECT 30 11 CONECT 31 12 CONECT 32 12 CONECT 33 13 CONECT 34 13 CONECT 35 14 CONECT 36 14 CONECT 37 17 CONECT 38 18 MASTER 0 0 0 0 0 0 0 0 38 0 74 0 END