HEADER PROTEIN 21-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 21-JUN-21 0 HETATM 1 C UNK 0 -4.257 3.110 -4.451 0.00 0.00 C+0 HETATM 2 O UNK 0 -2.914 2.715 -4.166 0.00 0.00 O+0 HETATM 3 C UNK 0 -2.163 3.688 -3.578 0.00 0.00 C+0 HETATM 4 O UNK 0 -2.554 4.816 -3.314 0.00 0.00 O+0 HETATM 5 C UNK 0 -0.766 3.168 -3.332 0.00 0.00 C+0 HETATM 6 C UNK 0 0.063 4.087 -2.429 0.00 0.00 C+0 HETATM 7 C UNK 0 -0.428 4.152 -0.980 0.00 0.00 C+0 HETATM 8 C UNK 0 -0.274 2.865 -0.287 0.00 0.00 C+0 HETATM 9 C UNK 0 -0.153 1.808 0.269 0.00 0.00 C+0 HETATM 10 C UNK 0 -0.010 0.554 0.918 0.00 0.00 C+0 HETATM 11 C UNK 0 -0.284 -0.593 0.279 0.00 0.00 C+0 HETATM 12 C UNK 0 -0.148 -1.959 0.900 0.00 0.00 C+0 HETATM 13 O UNK 0 -1.422 -2.624 0.805 0.00 0.00 O+0 HETATM 14 C UNK 0 -2.324 -2.242 1.837 0.00 0.00 C+0 HETATM 15 C UNK 0 0.869 -2.862 0.149 0.00 0.00 C+0 HETATM 16 O UNK 0 0.408 -3.120 -1.186 0.00 0.00 O+0 HETATM 17 C UNK 0 2.283 -2.276 0.097 0.00 0.00 C+0 HETATM 18 C UNK 0 3.287 -3.273 -0.490 0.00 0.00 C+0 HETATM 19 C UNK 0 4.675 -2.691 -0.512 0.00 0.00 C+0 HETATM 20 C UNK 0 5.702 -2.980 0.307 0.00 0.00 C+0 HETATM 21 Br UNK 0 5.567 -4.150 1.766 0.00 0.00 Br+0 HETATM 22 C UNK 0 6.994 -2.334 0.174 0.00 0.00 C+0 HETATM 23 C UNK 0 7.818 -2.365 -0.882 0.00 0.00 C+0 HETATM 24 Br UNK 0 7.571 -3.264 -2.485 0.00 0.00 Br+0 HETATM 25 H UNK 0 -4.770 2.259 -4.909 0.00 0.00 H+0 HETATM 26 H UNK 0 -4.783 3.376 -3.529 0.00 0.00 H+0 HETATM 27 H UNK 0 -4.268 3.944 -5.160 0.00 0.00 H+0 HETATM 28 H UNK 0 -0.829 2.164 -2.900 0.00 0.00 H+0 HETATM 29 H UNK 0 -0.272 3.091 -4.308 0.00 0.00 H+0 HETATM 30 H UNK 0 1.105 3.742 -2.445 0.00 0.00 H+0 HETATM 31 H UNK 0 0.062 5.102 -2.845 0.00 0.00 H+0 HETATM 32 H UNK 0 -1.473 4.476 -0.935 0.00 0.00 H+0 HETATM 33 H UNK 0 0.157 4.912 -0.448 0.00 0.00 H+0 HETATM 34 H UNK 0 0.331 0.556 1.948 0.00 0.00 H+0 HETATM 35 H UNK 0 -0.623 -0.571 -0.755 0.00 0.00 H+0 HETATM 36 H UNK 0 0.161 -1.893 1.951 0.00 0.00 H+0 HETATM 37 H UNK 0 -3.251 -2.805 1.705 0.00 0.00 H+0 HETATM 38 H UNK 0 -1.907 -2.486 2.820 0.00 0.00 H+0 HETATM 39 H UNK 0 -2.557 -1.175 1.780 0.00 0.00 H+0 HETATM 40 H UNK 0 0.892 -3.836 0.653 0.00 0.00 H+0 HETATM 41 H UNK 0 -0.549 -3.298 -1.091 0.00 0.00 H+0 HETATM 42 H UNK 0 2.596 -1.989 1.108 0.00 0.00 H+0 HETATM 43 H UNK 0 2.291 -1.371 -0.523 0.00 0.00 H+0 HETATM 44 H UNK 0 3.010 -3.526 -1.521 0.00 0.00 H+0 HETATM 45 H UNK 0 3.250 -4.213 0.070 0.00 0.00 H+0 HETATM 46 H UNK 0 4.831 -1.960 -1.305 0.00 0.00 H+0 HETATM 47 H UNK 0 7.325 -1.793 1.060 0.00 0.00 H+0 HETATM 48 H UNK 0 8.771 -1.848 -0.850 0.00 0.00 H+0 CONECT 1 2 25 26 27 CONECT 2 3 1 CONECT 3 5 2 4 CONECT 4 3 CONECT 5 6 3 28 29 CONECT 6 7 5 30 31 CONECT 7 8 6 32 33 CONECT 8 9 7 CONECT 9 8 10 CONECT 10 11 9 34 CONECT 11 12 10 35 CONECT 12 13 15 11 36 CONECT 13 12 14 CONECT 14 13 37 38 39 CONECT 15 12 17 16 40 CONECT 16 15 41 CONECT 17 18 15 42 43 CONECT 18 19 17 44 45 CONECT 19 18 20 46 CONECT 20 19 21 22 CONECT 21 20 CONECT 22 23 20 47 CONECT 23 22 48 24 CONECT 24 23 CONECT 25 1 CONECT 26 1 CONECT 27 1 CONECT 28 5 CONECT 29 5 CONECT 30 6 CONECT 31 6 CONECT 32 7 CONECT 33 7 CONECT 34 10 CONECT 35 11 CONECT 36 12 CONECT 37 14 CONECT 38 14 CONECT 39 14 CONECT 40 15 CONECT 41 16 CONECT 42 17 CONECT 43 17 CONECT 44 18 CONECT 45 18 CONECT 46 19 CONECT 47 22 CONECT 48 23 MASTER 0 0 0 0 0 0 0 0 48 0 94 0 END