HEADER PROTEIN 24-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 24-JUN-21 0 HETATM 1 C UNK 0 6.402 1.893 -1.212 0.00 0.00 C+0 HETATM 2 C UNK 0 5.612 1.375 -0.056 0.00 0.00 C+0 HETATM 3 C UNK 0 4.187 1.897 -0.147 0.00 0.00 C+0 HETATM 4 C UNK 0 3.393 1.377 1.050 0.00 0.00 C+0 HETATM 5 C UNK 0 3.312 -0.060 1.173 0.00 0.00 C+0 HETATM 6 C UNK 0 2.586 -0.987 0.276 0.00 0.00 C+0 HETATM 7 O UNK 0 2.967 -0.895 -1.081 0.00 0.00 O+0 HETATM 8 C UNK 0 3.494 -2.086 -1.584 0.00 0.00 C+0 HETATM 9 C UNK 0 1.106 -1.026 0.446 0.00 0.00 C+0 HETATM 10 C UNK 0 0.568 -2.162 1.051 0.00 0.00 C+0 HETATM 11 O UNK 0 1.349 -3.179 1.549 0.00 0.00 O+0 HETATM 12 C UNK 0 -0.803 -2.273 1.163 0.00 0.00 C+0 HETATM 13 C UNK 0 -1.628 -1.285 0.686 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.131 -0.123 0.060 0.00 0.00 C+0 HETATM 15 C UNK 0 0.242 -0.044 -0.032 0.00 0.00 C+0 HETATM 16 O UNK 0 0.836 1.039 -0.626 0.00 0.00 O+0 HETATM 17 C UNK 0 -2.052 0.907 -0.416 0.00 0.00 C+0 HETATM 18 O UNK 0 -1.641 1.937 -0.974 0.00 0.00 O+0 HETATM 19 C UNK 0 -3.490 0.705 -0.220 0.00 0.00 C+0 HETATM 20 C UNK 0 -4.011 -0.424 0.401 0.00 0.00 C+0 HETATM 21 C UNK 0 -5.361 -0.593 0.605 0.00 0.00 C+0 HETATM 22 C UNK 0 -6.263 0.368 0.195 0.00 0.00 C+0 HETATM 23 O UNK 0 -7.637 0.208 0.400 0.00 0.00 O+0 HETATM 24 C UNK 0 -8.066 -0.980 1.067 0.00 0.00 C+0 HETATM 25 C UNK 0 -5.747 1.482 -0.423 0.00 0.00 C+0 HETATM 26 Br UNK 0 -6.997 2.798 -1.015 0.00 0.00 Br+0 HETATM 27 C UNK 0 -4.401 1.672 -0.638 0.00 0.00 C+0 HETATM 28 O UNK 0 -3.878 2.823 -1.278 0.00 0.00 O+0 HETATM 29 C UNK 0 -3.075 -1.433 0.860 0.00 0.00 C+0 HETATM 30 O UNK 0 -3.510 -2.476 1.426 0.00 0.00 O+0 HETATM 31 H UNK 0 7.030 1.046 -1.612 0.00 0.00 H+0 HETATM 32 H UNK 0 7.195 2.636 -0.868 0.00 0.00 H+0 HETATM 33 H UNK 0 5.806 2.330 -2.040 0.00 0.00 H+0 HETATM 34 H UNK 0 5.533 0.269 -0.170 0.00 0.00 H+0 HETATM 35 H UNK 0 6.130 1.681 0.888 0.00 0.00 H+0 HETATM 36 H UNK 0 4.232 3.001 -0.103 0.00 0.00 H+0 HETATM 37 H UNK 0 3.734 1.560 -1.055 0.00 0.00 H+0 HETATM 38 H UNK 0 3.980 1.752 1.972 0.00 0.00 H+0 HETATM 39 H UNK 0 2.447 1.923 1.153 0.00 0.00 H+0 HETATM 40 H UNK 0 2.820 -0.253 2.222 0.00 0.00 H+0 HETATM 41 H UNK 0 4.353 -0.516 1.410 0.00 0.00 H+0 HETATM 42 H UNK 0 2.952 -2.048 0.512 0.00 0.00 H+0 HETATM 43 H UNK 0 4.380 -2.441 -1.076 0.00 0.00 H+0 HETATM 44 H UNK 0 2.678 -2.844 -1.442 0.00 0.00 H+0 HETATM 45 H UNK 0 3.645 -2.061 -2.689 0.00 0.00 H+0 HETATM 46 H UNK 0 2.309 -3.271 1.599 0.00 0.00 H+0 HETATM 47 H UNK 0 -1.214 -3.162 1.641 0.00 0.00 H+0 HETATM 48 H UNK 0 0.423 1.806 -1.039 0.00 0.00 H+0 HETATM 49 H UNK 0 -5.715 -1.512 1.098 0.00 0.00 H+0 HETATM 50 H UNK 0 -7.880 -1.890 0.438 0.00 0.00 H+0 HETATM 51 H UNK 0 -7.474 -1.105 2.026 0.00 0.00 H+0 HETATM 52 H UNK 0 -9.148 -0.861 1.301 0.00 0.00 H+0 HETATM 53 H UNK 0 -4.579 3.509 -1.553 0.00 0.00 H+0 CONECT 1 2 31 32 33 CONECT 2 1 3 34 35 CONECT 3 2 4 36 37 CONECT 4 3 5 38 39 CONECT 5 4 6 40 41 CONECT 6 5 7 9 42 CONECT 7 6 8 CONECT 8 7 43 44 45 CONECT 9 6 10 15 CONECT 10 9 11 12 CONECT 11 10 46 CONECT 12 10 13 47 CONECT 13 12 14 29 CONECT 14 13 15 17 CONECT 15 14 16 9 CONECT 16 15 48 CONECT 17 14 18 19 CONECT 18 17 CONECT 19 17 20 27 CONECT 20 19 21 29 CONECT 21 20 22 49 CONECT 22 21 23 25 CONECT 23 22 24 CONECT 24 23 50 51 52 CONECT 25 22 26 27 CONECT 26 25 CONECT 27 25 28 19 CONECT 28 27 53 CONECT 29 20 30 13 CONECT 30 29 CONECT 31 1 CONECT 32 1 CONECT 33 1 CONECT 34 2 CONECT 35 2 CONECT 36 3 CONECT 37 3 CONECT 38 4 CONECT 39 4 CONECT 40 5 CONECT 41 5 CONECT 42 6 CONECT 43 8 CONECT 44 8 CONECT 45 8 CONECT 46 11 CONECT 47 12 CONECT 48 16 CONECT 49 21 CONECT 50 24 CONECT 51 24 CONECT 52 24 CONECT 53 28 MASTER 0 0 0 0 0 0 0 0 53 0 110 0 END