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 C UNK 0 -4.445 -4.337 0.375 0.00 0.00 C+0 HETATM 2 C UNK 0 -4.218 -3.622 -0.740 0.00 0.00 C+0 HETATM 3 C UNK 0 -5.366 -3.128 -1.580 0.00 0.00 C+0 HETATM 4 C UNK 0 -2.792 -3.298 -1.187 0.00 0.00 C+0 HETATM 5 C UNK 0 -2.473 -4.005 -2.519 0.00 0.00 C+0 HETATM 6 C UNK 0 -0.979 -3.956 -2.834 0.00 0.00 C+0 HETATM 7 C UNK 0 -0.414 -2.570 -2.718 0.00 0.00 C+0 HETATM 8 C UNK 0 0.631 -2.171 -3.711 0.00 0.00 C+0 HETATM 9 O UNK 0 -0.057 -2.229 -1.362 0.00 0.00 O+0 HETATM 10 C UNK 0 -1.151 -1.505 -1.930 0.00 0.00 C+0 HETATM 11 C UNK 0 -2.503 -1.772 -1.308 0.00 0.00 C+0 HETATM 12 C UNK 0 -2.620 -1.066 0.068 0.00 0.00 C+0 HETATM 13 C UNK 0 -2.518 0.458 0.061 0.00 0.00 C+0 HETATM 14 C UNK 0 -3.282 1.193 -0.768 0.00 0.00 C+0 HETATM 15 C UNK 0 -1.556 1.056 1.091 0.00 0.00 C+0 HETATM 16 C UNK 0 -1.828 2.526 1.465 0.00 0.00 C+0 HETATM 17 C UNK 0 -0.856 3.024 2.538 0.00 0.00 C+0 HETATM 18 C UNK 0 0.616 2.875 2.110 0.00 0.00 C+0 HETATM 19 C UNK 0 1.517 3.344 3.258 0.00 0.00 C+0 HETATM 20 O UNK 0 0.821 3.759 1.000 0.00 0.00 O+0 HETATM 21 C UNK 0 0.884 1.412 1.695 0.00 0.00 C+0 HETATM 22 Br UNK 0 2.704 1.207 0.969 0.00 0.00 Br+0 HETATM 23 C UNK 0 -0.095 0.900 0.634 0.00 0.00 C+0 HETATM 24 H UNK 0 -5.452 -4.577 0.704 0.00 0.00 H+0 HETATM 25 H UNK 0 -3.631 -4.706 0.993 0.00 0.00 H+0 HETATM 26 H UNK 0 -5.285 -3.497 -2.607 0.00 0.00 H+0 HETATM 27 H UNK 0 -6.332 -3.468 -1.190 0.00 0.00 H+0 HETATM 28 H UNK 0 -5.392 -2.035 -1.600 0.00 0.00 H+0 HETATM 29 H UNK 0 -2.101 -3.708 -0.435 0.00 0.00 H+0 HETATM 30 H UNK 0 -3.025 -3.527 -3.339 0.00 0.00 H+0 HETATM 31 H UNK 0 -2.792 -5.054 -2.488 0.00 0.00 H+0 HETATM 32 H UNK 0 -0.436 -4.630 -2.159 0.00 0.00 H+0 HETATM 33 H UNK 0 -0.826 -4.344 -3.848 0.00 0.00 H+0 HETATM 34 H UNK 0 0.204 -2.146 -4.719 0.00 0.00 H+0 HETATM 35 H UNK 0 1.459 -2.886 -3.705 0.00 0.00 H+0 HETATM 36 H UNK 0 1.041 -1.179 -3.495 0.00 0.00 H+0 HETATM 37 H UNK 0 -0.996 -0.466 -2.192 0.00 0.00 H+0 HETATM 38 H UNK 0 -3.240 -1.344 -1.998 0.00 0.00 H+0 HETATM 39 H UNK 0 -1.849 -1.480 0.731 0.00 0.00 H+0 HETATM 40 H UNK 0 -3.579 -1.314 0.543 0.00 0.00 H+0 HETATM 41 H UNK 0 -3.246 2.276 -0.791 0.00 0.00 H+0 HETATM 42 H UNK 0 -3.986 0.734 -1.454 0.00 0.00 H+0 HETATM 43 H UNK 0 -1.689 0.477 2.016 0.00 0.00 H+0 HETATM 44 H UNK 0 -2.854 2.634 1.838 0.00 0.00 H+0 HETATM 45 H UNK 0 -1.738 3.174 0.584 0.00 0.00 H+0 HETATM 46 H UNK 0 -1.084 4.079 2.737 0.00 0.00 H+0 HETATM 47 H UNK 0 -1.035 2.470 3.469 0.00 0.00 H+0 HETATM 48 H UNK 0 1.248 4.361 3.568 0.00 0.00 H+0 HETATM 49 H UNK 0 2.568 3.395 2.959 0.00 0.00 H+0 HETATM 50 H UNK 0 1.432 2.687 4.130 0.00 0.00 H+0 HETATM 51 H UNK 0 1.718 3.587 0.656 0.00 0.00 H+0 HETATM 52 H UNK 0 0.854 0.755 2.572 0.00 0.00 H+0 HETATM 53 H UNK 0 0.125 -0.155 0.431 0.00 0.00 H+0 HETATM 54 H UNK 0 0.054 1.433 -0.315 0.00 0.00 H+0 CONECT 1 2 24 25 CONECT 2 4 3 1 CONECT 3 2 26 27 28 CONECT 4 5 2 11 29 CONECT 5 6 4 30 31 CONECT 6 5 7 32 33 CONECT 7 10 9 6 8 CONECT 8 7 34 35 36 CONECT 9 7 10 CONECT 10 7 9 11 37 CONECT 11 12 10 4 38 CONECT 12 11 13 39 40 CONECT 13 12 15 14 CONECT 14 13 41 42 CONECT 15 23 13 16 43 CONECT 16 17 15 44 45 CONECT 17 16 18 46 47 CONECT 18 17 21 19 20 CONECT 19 18 48 49 50 CONECT 20 18 51 CONECT 21 18 23 22 52 CONECT 22 21 CONECT 23 15 21 53 54 CONECT 24 1 CONECT 25 1 CONECT 26 3 CONECT 27 3 CONECT 28 3 CONECT 29 4 CONECT 30 5 CONECT 31 5 CONECT 32 6 CONECT 33 6 CONECT 34 8 CONECT 35 8 CONECT 36 8 CONECT 37 10 CONECT 38 11 CONECT 39 12 CONECT 40 12 CONECT 41 14 CONECT 42 14 CONECT 43 15 CONECT 44 16 CONECT 45 16 CONECT 46 17 CONECT 47 17 CONECT 48 19 CONECT 49 19 CONECT 50 19 CONECT 51 20 CONECT 52 21 CONECT 53 23 CONECT 54 23 MASTER 0 0 0 0 0 0 0 0 54 0 112 0 END