HEADER PROTEIN 20-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 20-JUN-21 0 HETATM 1 C UNK 0 3.463 -5.026 -3.326 0.00 0.00 C+0 HETATM 2 O UNK 0 3.619 -3.831 -4.093 0.00 0.00 O+0 HETATM 3 C UNK 0 2.639 -2.907 -3.782 0.00 0.00 C+0 HETATM 4 C UNK 0 1.509 -2.790 -4.507 0.00 0.00 C+0 HETATM 5 Br UNK 0 1.111 -3.869 -5.988 0.00 0.00 Br+0 HETATM 6 C UNK 0 0.455 -1.754 -4.184 0.00 0.00 C+0 HETATM 7 O UNK 0 0.606 -0.663 -5.105 0.00 0.00 O+0 HETATM 8 C UNK 0 0.531 -1.244 -2.712 0.00 0.00 C+0 HETATM 9 C UNK 0 1.952 -1.202 -2.186 0.00 0.00 C+0 HETATM 10 C UNK 0 2.931 -1.965 -2.703 0.00 0.00 C+0 HETATM 11 Br UNK 0 4.673 -1.833 -2.024 0.00 0.00 Br+0 HETATM 12 C UNK 0 -0.202 0.082 -2.536 0.00 0.00 C+0 HETATM 13 C UNK 0 -0.839 -0.202 -1.234 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.464 0.908 -0.424 0.00 0.00 C+0 HETATM 15 O UNK 0 -1.389 2.059 -0.818 0.00 0.00 O+0 HETATM 16 N UNK 0 -2.073 0.475 0.728 0.00 0.00 N+0 HETATM 17 C UNK 0 -2.755 1.368 1.637 0.00 0.00 C+0 HETATM 18 C UNK 0 -1.793 2.138 2.545 0.00 0.00 C+0 HETATM 19 C UNK 0 -0.938 1.246 3.446 0.00 0.00 C+0 HETATM 20 C UNK 0 -1.746 0.541 4.501 0.00 0.00 C+0 HETATM 21 O UNK 0 -2.929 0.689 4.752 0.00 0.00 O+0 HETATM 22 O UNK 0 -0.997 -0.327 5.209 0.00 0.00 O+0 HETATM 23 N UNK 0 -0.862 -1.440 -0.853 0.00 0.00 N+0 HETATM 24 O UNK 0 -0.195 -2.174 -1.866 0.00 0.00 O+0 HETATM 25 H UNK 0 3.543 -4.828 -2.252 0.00 0.00 H+0 HETATM 26 H UNK 0 2.507 -5.514 -3.546 0.00 0.00 H+0 HETATM 27 H UNK 0 4.267 -5.712 -3.606 0.00 0.00 H+0 HETATM 28 H UNK 0 -0.544 -2.180 -4.344 0.00 0.00 H+0 HETATM 29 H UNK 0 0.697 -1.050 -5.996 0.00 0.00 H+0 HETATM 30 H UNK 0 2.162 -0.541 -1.350 0.00 0.00 H+0 HETATM 31 H UNK 0 0.454 0.955 -2.505 0.00 0.00 H+0 HETATM 32 H UNK 0 -1.000 0.238 -3.269 0.00 0.00 H+0 HETATM 33 H UNK 0 -2.063 -0.527 0.907 0.00 0.00 H+0 HETATM 34 H UNK 0 -3.461 0.766 2.216 0.00 0.00 H+0 HETATM 35 H UNK 0 -3.337 2.081 1.043 0.00 0.00 H+0 HETATM 36 H UNK 0 -1.121 2.746 1.926 0.00 0.00 H+0 HETATM 37 H UNK 0 -2.374 2.836 3.159 0.00 0.00 H+0 HETATM 38 H UNK 0 -0.201 1.871 3.963 0.00 0.00 H+0 HETATM 39 H UNK 0 -0.402 0.500 2.852 0.00 0.00 H+0 HETATM 40 H UNK 0 -1.619 -0.707 5.865 0.00 0.00 H+0 CONECT 1 2 25 26 27 CONECT 2 3 1 CONECT 3 4 10 2 CONECT 4 3 5 6 CONECT 5 4 CONECT 6 8 7 4 28 CONECT 7 6 29 CONECT 8 24 6 9 12 CONECT 9 8 10 30 CONECT 10 9 3 11 CONECT 11 10 CONECT 12 13 8 31 32 CONECT 13 14 23 12 CONECT 14 15 13 16 CONECT 15 14 CONECT 16 17 14 33 CONECT 17 16 18 34 35 CONECT 18 19 17 36 37 CONECT 19 18 20 38 39 CONECT 20 19 22 21 CONECT 21 20 CONECT 22 20 40 CONECT 23 24 13 CONECT 24 8 23 CONECT 25 1 CONECT 26 1 CONECT 27 1 CONECT 28 6 CONECT 29 7 CONECT 30 9 CONECT 31 12 CONECT 32 12 CONECT 33 16 CONECT 34 17 CONECT 35 17 CONECT 36 18 CONECT 37 18 CONECT 38 19 CONECT 39 19 CONECT 40 22 MASTER 0 0 0 0 0 0 0 0 40 0 82 0 END