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 4.871 -4.051 -2.044 0.00 0.00 C+0 HETATM 2 O UNK 0 3.881 -4.694 -1.238 0.00 0.00 O+0 HETATM 3 C UNK 0 2.831 -3.840 -0.947 0.00 0.00 C+0 HETATM 4 C UNK 0 2.848 -3.008 0.115 0.00 0.00 C+0 HETATM 5 Br UNK 0 4.281 -2.905 1.328 0.00 0.00 Br+0 HETATM 6 C UNK 0 1.693 -2.090 0.444 0.00 0.00 C+0 HETATM 7 O UNK 0 2.075 -0.781 -0.003 0.00 0.00 O+0 HETATM 8 C UNK 0 0.330 -2.530 -0.189 0.00 0.00 C+0 HETATM 9 C UNK 0 0.482 -3.384 -1.423 0.00 0.00 C+0 HETATM 10 C UNK 0 1.636 -3.975 -1.776 0.00 0.00 C+0 HETATM 11 Br UNK 0 1.671 -5.068 -3.304 0.00 0.00 Br+0 HETATM 12 C UNK 0 -0.648 -1.381 -0.433 0.00 0.00 C+0 HETATM 13 C UNK 0 -1.342 -1.425 0.869 0.00 0.00 C+0 HETATM 14 C UNK 0 -2.226 -0.285 1.320 0.00 0.00 C+0 HETATM 15 O UNK 0 -2.502 0.618 0.548 0.00 0.00 O+0 HETATM 16 N UNK 0 -2.654 -0.412 2.621 0.00 0.00 N+0 HETATM 17 C UNK 0 -3.617 0.473 3.236 0.00 0.00 C+0 HETATM 18 C UNK 0 -3.216 1.955 3.345 0.00 0.00 C+0 HETATM 19 O UNK 0 -4.378 2.671 3.800 0.00 0.00 O+0 HETATM 20 C UNK 0 -2.087 2.254 4.341 0.00 0.00 C+0 HETATM 21 C UNK 0 -0.715 1.687 3.987 0.00 0.00 C+0 HETATM 22 N UNK 0 -0.282 2.153 2.690 0.00 0.00 N+0 HETATM 23 C UNK 0 0.622 1.565 1.887 0.00 0.00 C+0 HETATM 24 N UNK 0 1.432 0.616 2.189 0.00 0.00 N+0 HETATM 25 N UNK 0 0.592 2.045 0.639 0.00 0.00 N+0 HETATM 26 N UNK 0 -1.208 -2.514 1.559 0.00 0.00 N+0 HETATM 27 O UNK 0 -0.360 -3.356 0.792 0.00 0.00 O+0 HETATM 28 H UNK 0 4.441 -3.645 -2.966 0.00 0.00 H+0 HETATM 29 H UNK 0 5.617 -4.803 -2.319 0.00 0.00 H+0 HETATM 30 H UNK 0 5.380 -3.255 -1.493 0.00 0.00 H+0 HETATM 31 H UNK 0 1.569 -2.058 1.535 0.00 0.00 H+0 HETATM 32 H UNK 0 2.046 -0.220 0.813 0.00 0.00 H+0 HETATM 33 H UNK 0 -0.413 -3.559 -2.015 0.00 0.00 H+0 HETATM 34 H UNK 0 -1.389 -1.597 -1.210 0.00 0.00 H+0 HETATM 35 H UNK 0 -0.192 -0.414 -0.642 0.00 0.00 H+0 HETATM 36 H UNK 0 -2.390 -1.274 3.094 0.00 0.00 H+0 HETATM 37 H UNK 0 -3.843 0.071 4.230 0.00 0.00 H+0 HETATM 38 H UNK 0 -4.544 0.394 2.654 0.00 0.00 H+0 HETATM 39 H UNK 0 -2.970 2.355 2.356 0.00 0.00 H+0 HETATM 40 H UNK 0 -4.220 3.618 3.638 0.00 0.00 H+0 HETATM 41 H UNK 0 -2.378 1.893 5.337 0.00 0.00 H+0 HETATM 42 H UNK 0 -2.001 3.345 4.448 0.00 0.00 H+0 HETATM 43 H UNK 0 0.012 2.011 4.741 0.00 0.00 H+0 HETATM 44 H UNK 0 -0.740 0.594 4.026 0.00 0.00 H+0 HETATM 45 H UNK 0 -0.623 3.057 2.389 0.00 0.00 H+0 HETATM 46 H UNK 0 1.330 0.413 3.188 0.00 0.00 H+0 HETATM 47 H UNK 0 -0.242 2.478 0.267 0.00 0.00 H+0 HETATM 48 H UNK 0 1.245 1.663 -0.035 0.00 0.00 H+0 CONECT 1 2 28 29 30 CONECT 2 3 1 CONECT 3 4 10 2 CONECT 4 3 6 5 CONECT 5 4 CONECT 6 8 31 7 4 CONECT 7 6 32 CONECT 8 12 27 6 9 CONECT 9 8 10 33 CONECT 10 9 3 11 CONECT 11 10 CONECT 12 13 8 34 35 CONECT 13 12 26 14 CONECT 14 16 15 13 CONECT 15 14 CONECT 16 14 17 36 CONECT 17 16 18 37 38 CONECT 18 17 20 19 39 CONECT 19 18 40 CONECT 20 18 21 41 42 CONECT 21 20 22 43 44 CONECT 22 21 23 45 CONECT 23 22 25 24 CONECT 24 23 46 CONECT 25 23 47 48 CONECT 26 27 13 CONECT 27 8 26 CONECT 28 1 CONECT 29 1 CONECT 30 1 CONECT 31 6 CONECT 32 7 CONECT 33 9 CONECT 34 12 CONECT 35 12 CONECT 36 16 CONECT 37 17 CONECT 38 17 CONECT 39 18 CONECT 40 19 CONECT 41 20 CONECT 42 20 CONECT 43 21 CONECT 44 21 CONECT 45 22 CONECT 46 24 CONECT 47 25 CONECT 48 25 MASTER 0 0 0 0 0 0 0 0 48 0 98 0 END