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 1.037 4.063 1.237 0.00 0.00 C+0 HETATM 2 C UNK 0 1.007 2.576 1.490 0.00 0.00 C+0 HETATM 3 O UNK 0 1.078 2.131 2.651 0.00 0.00 O+0 HETATM 4 O UNK 0 0.900 1.780 0.395 0.00 0.00 O+0 HETATM 5 C UNK 0 0.856 0.351 0.498 0.00 0.00 C+0 HETATM 6 C UNK 0 2.222 -0.081 0.012 0.00 0.00 C+0 HETATM 7 C UNK 0 2.357 -1.536 -0.257 0.00 0.00 C+0 HETATM 8 C UNK 0 3.748 -1.877 -0.663 0.00 0.00 C+0 HETATM 9 Cl UNK 0 1.867 -2.420 1.217 0.00 0.00 Cl+0 HETATM 10 C UNK 0 1.334 -1.865 -1.327 0.00 0.00 C+0 HETATM 11 Br UNK 0 1.668 -1.099 -3.009 0.00 0.00 Br+0 HETATM 12 C UNK 0 0.003 -1.643 -0.712 0.00 0.00 C+0 HETATM 13 C UNK 0 -0.300 -0.281 -0.152 0.00 0.00 C+0 HETATM 14 C UNK 0 -0.986 0.636 -1.129 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.247 1.733 -1.744 0.00 0.00 C+0 HETATM 16 C UNK 0 -1.880 -0.080 -2.117 0.00 0.00 C+0 HETATM 17 C UNK 0 -2.966 -0.589 -1.225 0.00 0.00 C+0 HETATM 18 C UNK 0 -2.653 0.063 0.072 0.00 0.00 C+0 HETATM 19 O UNK 0 -2.014 1.254 -0.355 0.00 0.00 O+0 HETATM 20 C UNK 0 -1.446 -0.534 0.800 0.00 0.00 C+0 HETATM 21 C UNK 0 -1.787 -1.971 1.049 0.00 0.00 C+0 HETATM 22 C UNK 0 -1.393 0.151 2.115 0.00 0.00 C+0 HETATM 23 H UNK 0 1.451 4.562 2.139 0.00 0.00 H+0 HETATM 24 H UNK 0 -0.002 4.359 1.009 0.00 0.00 H+0 HETATM 25 H UNK 0 1.665 4.216 0.348 0.00 0.00 H+0 HETATM 26 H UNK 0 0.866 0.116 1.580 0.00 0.00 H+0 HETATM 27 H UNK 0 2.583 0.463 -0.880 0.00 0.00 H+0 HETATM 28 H UNK 0 2.951 0.185 0.813 0.00 0.00 H+0 HETATM 29 H UNK 0 4.355 -0.970 -0.761 0.00 0.00 H+0 HETATM 30 H UNK 0 4.266 -2.537 0.090 0.00 0.00 H+0 HETATM 31 H UNK 0 3.699 -2.382 -1.662 0.00 0.00 H+0 HETATM 32 H UNK 0 1.420 -2.992 -1.445 0.00 0.00 H+0 HETATM 33 H UNK 0 -0.762 -2.068 -1.353 0.00 0.00 H+0 HETATM 34 H UNK 0 0.038 -2.326 0.198 0.00 0.00 H+0 HETATM 35 H UNK 0 -0.419 2.743 -1.256 0.00 0.00 H+0 HETATM 36 H UNK 0 -0.701 1.916 -2.770 0.00 0.00 H+0 HETATM 37 H UNK 0 0.811 1.660 -1.922 0.00 0.00 H+0 HETATM 38 H UNK 0 -2.287 0.745 -2.775 0.00 0.00 H+0 HETATM 39 H UNK 0 -1.402 -0.785 -2.773 0.00 0.00 H+0 HETATM 40 H UNK 0 -3.113 -1.667 -1.216 0.00 0.00 H+0 HETATM 41 H UNK 0 -3.946 -0.156 -1.563 0.00 0.00 H+0 HETATM 42 H UNK 0 -3.491 0.254 0.732 0.00 0.00 H+0 HETATM 43 H UNK 0 -2.795 -1.929 1.573 0.00 0.00 H+0 HETATM 44 H UNK 0 -1.141 -2.452 1.840 0.00 0.00 H+0 HETATM 45 H UNK 0 -1.970 -2.594 0.178 0.00 0.00 H+0 HETATM 46 H UNK 0 -1.461 1.253 2.078 0.00 0.00 H+0 HETATM 47 H UNK 0 -0.645 -0.242 2.833 0.00 0.00 H+0 HETATM 48 H UNK 0 -2.378 -0.130 2.621 0.00 0.00 H+0 CONECT 1 2 23 24 25 CONECT 2 1 3 4 CONECT 3 2 CONECT 4 2 5 CONECT 5 4 6 13 26 CONECT 6 5 7 27 28 CONECT 7 6 8 9 10 CONECT 8 7 29 30 31 CONECT 9 7 CONECT 10 7 11 12 32 CONECT 11 10 CONECT 12 10 13 33 34 CONECT 13 12 14 5 20 CONECT 14 13 15 16 19 CONECT 15 14 35 36 37 CONECT 16 14 17 38 39 CONECT 17 16 18 40 41 CONECT 18 17 19 20 42 CONECT 19 18 14 CONECT 20 18 21 22 13 CONECT 21 20 43 44 45 CONECT 22 20 46 47 48 CONECT 23 1 CONECT 24 1 CONECT 25 1 CONECT 26 5 CONECT 27 6 CONECT 28 6 CONECT 29 8 CONECT 30 8 CONECT 31 8 CONECT 32 10 CONECT 33 12 CONECT 34 12 CONECT 35 15 CONECT 36 15 CONECT 37 15 CONECT 38 16 CONECT 39 16 CONECT 40 17 CONECT 41 17 CONECT 42 18 CONECT 43 21 CONECT 44 21 CONECT 45 21 CONECT 46 22 CONECT 47 22 CONECT 48 22 MASTER 0 0 0 0 0 0 0 0 48 0 100 0 END