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 6.543 1.613 -4.148 0.00 0.00 C+0 HETATM 2 O UNK 0 6.333 1.439 -2.784 0.00 0.00 O+0 HETATM 3 C UNK 0 5.400 0.586 -2.227 0.00 0.00 C+0 HETATM 4 O UNK 0 4.693 -0.078 -3.026 0.00 0.00 O+0 HETATM 5 C UNK 0 5.238 0.458 -0.751 0.00 0.00 C+0 HETATM 6 C UNK 0 6.027 1.198 0.095 0.00 0.00 C+0 HETATM 7 S UNK 0 5.456 0.695 1.625 0.00 0.00 S+0 HETATM 8 C UNK 0 4.267 -0.409 1.103 0.00 0.00 C+0 HETATM 9 C UNK 0 3.369 -1.222 1.970 0.00 0.00 C+0 HETATM 10 O UNK 0 2.044 -1.224 1.523 0.00 0.00 O+0 HETATM 11 C UNK 0 0.964 -0.699 2.226 0.00 0.00 C+0 HETATM 12 O UNK 0 1.271 -0.194 3.354 0.00 0.00 O+0 HETATM 13 C UNK 0 -0.402 -0.732 1.702 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.354 -0.081 2.646 0.00 0.00 C+0 HETATM 15 C UNK 0 -0.521 -0.109 0.308 0.00 0.00 C+0 HETATM 16 C UNK 0 -0.096 1.321 0.324 0.00 0.00 C+0 HETATM 17 C UNK 0 -0.156 2.087 -0.925 0.00 0.00 C+0 HETATM 18 C UNK 0 -1.457 2.407 -1.553 0.00 0.00 C+0 HETATM 19 C UNK 0 -2.366 3.318 -0.803 0.00 0.00 C+0 HETATM 20 C UNK 0 -1.733 4.682 -0.557 0.00 0.00 C+0 HETATM 21 Cl UNK 0 -3.798 3.591 -1.868 0.00 0.00 Cl+0 HETATM 22 Cl UNK 0 -2.961 2.603 0.677 0.00 0.00 Cl+0 HETATM 23 O UNK 0 -1.842 -0.286 -0.080 0.00 0.00 O+0 HETATM 24 C UNK 0 -2.226 -1.175 -1.099 0.00 0.00 C+0 HETATM 25 O UNK 0 -1.306 -1.815 -1.654 0.00 0.00 O+0 HETATM 26 C UNK 0 -3.652 -1.336 -1.486 0.00 0.00 C+0 HETATM 27 C UNK 0 -4.005 -2.213 -2.485 0.00 0.00 C+0 HETATM 28 S UNK 0 -5.701 -2.018 -2.528 0.00 0.00 S+0 HETATM 29 C UNK 0 -5.855 -0.852 -1.292 0.00 0.00 C+0 HETATM 30 C UNK 0 -7.082 -0.167 -0.737 0.00 0.00 C+0 HETATM 31 O UNK 0 -7.077 -0.129 0.638 0.00 0.00 O+0 HETATM 32 C UNK 0 -8.276 -0.988 -1.234 0.00 0.00 C+0 HETATM 33 O UNK 0 -9.415 -0.352 -0.755 0.00 0.00 O+0 HETATM 34 N UNK 0 -4.603 -0.673 -0.912 0.00 0.00 N+0 HETATM 35 C UNK 0 3.924 -2.614 2.180 0.00 0.00 C+0 HETATM 36 C UNK 0 3.088 -3.382 3.185 0.00 0.00 C+0 HETATM 37 C UNK 0 5.332 -2.600 2.682 0.00 0.00 C+0 HETATM 38 O UNK 0 3.900 -3.355 0.992 0.00 0.00 O+0 HETATM 39 N UNK 0 4.365 -0.338 -0.211 0.00 0.00 N+0 HETATM 40 H UNK 0 6.146 0.801 -4.776 0.00 0.00 H+0 HETATM 41 H UNK 0 6.190 2.628 -4.492 0.00 0.00 H+0 HETATM 42 H UNK 0 7.653 1.638 -4.318 0.00 0.00 H+0 HETATM 43 H UNK 0 6.817 1.922 -0.176 0.00 0.00 H+0 HETATM 44 H UNK 0 3.362 -0.734 2.967 0.00 0.00 H+0 HETATM 45 H UNK 0 -0.727 -1.799 1.574 0.00 0.00 H+0 HETATM 46 H UNK 0 -0.994 0.906 2.985 0.00 0.00 H+0 HETATM 47 H UNK 0 -2.319 0.051 2.110 0.00 0.00 H+0 HETATM 48 H UNK 0 -1.602 -0.747 3.514 0.00 0.00 H+0 HETATM 49 H UNK 0 0.189 -0.715 -0.324 0.00 0.00 H+0 HETATM 50 H UNK 0 0.996 1.339 0.658 0.00 0.00 H+0 HETATM 51 H UNK 0 -0.611 1.858 1.187 0.00 0.00 H+0 HETATM 52 H UNK 0 0.466 1.507 -1.688 0.00 0.00 H+0 HETATM 53 H UNK 0 0.445 3.041 -0.749 0.00 0.00 H+0 HETATM 54 H UNK 0 -1.267 2.938 -2.551 0.00 0.00 H+0 HETATM 55 H UNK 0 -2.054 1.520 -1.845 0.00 0.00 H+0 HETATM 56 H UNK 0 -0.725 4.619 -0.146 0.00 0.00 H+0 HETATM 57 H UNK 0 -2.454 5.248 0.065 0.00 0.00 H+0 HETATM 58 H UNK 0 -1.669 5.206 -1.540 0.00 0.00 H+0 HETATM 59 H UNK 0 -3.332 -2.858 -3.079 0.00 0.00 H+0 HETATM 60 H UNK 0 -7.166 0.854 -1.143 0.00 0.00 H+0 HETATM 61 H UNK 0 -6.486 -0.842 0.986 0.00 0.00 H+0 HETATM 62 H UNK 0 -8.300 -0.928 -2.352 0.00 0.00 H+0 HETATM 63 H UNK 0 -8.191 -2.019 -0.867 0.00 0.00 H+0 HETATM 64 H UNK 0 -9.527 -0.425 0.209 0.00 0.00 H+0 HETATM 65 H UNK 0 3.614 -4.286 3.551 0.00 0.00 H+0 HETATM 66 H UNK 0 3.016 -2.708 4.089 0.00 0.00 H+0 HETATM 67 H UNK 0 2.074 -3.601 2.803 0.00 0.00 H+0 HETATM 68 H UNK 0 6.091 -2.377 1.918 0.00 0.00 H+0 HETATM 69 H UNK 0 5.508 -1.912 3.526 0.00 0.00 H+0 HETATM 70 H UNK 0 5.562 -3.623 3.062 0.00 0.00 H+0 HETATM 71 H UNK 0 2.965 -3.461 0.728 0.00 0.00 H+0 CONECT 1 2 40 41 42 CONECT 2 1 3 CONECT 3 2 4 5 CONECT 4 3 CONECT 5 3 6 39 CONECT 6 5 7 43 CONECT 7 6 8 CONECT 8 7 9 39 CONECT 9 8 10 35 44 CONECT 10 9 11 CONECT 11 10 12 13 CONECT 12 11 CONECT 13 11 14 15 45 CONECT 14 13 46 47 48 CONECT 15 13 16 23 49 CONECT 16 15 17 50 51 CONECT 17 16 18 52 53 CONECT 18 17 19 54 55 CONECT 19 18 20 21 22 CONECT 20 19 56 57 58 CONECT 21 19 CONECT 22 19 CONECT 23 15 24 CONECT 24 23 25 26 CONECT 25 24 CONECT 26 24 27 34 CONECT 27 26 28 59 CONECT 28 27 29 CONECT 29 28 30 34 CONECT 30 29 31 32 60 CONECT 31 30 61 CONECT 32 30 33 62 63 CONECT 33 32 64 CONECT 34 29 26 CONECT 35 9 36 37 38 CONECT 36 35 65 66 67 CONECT 37 35 68 69 70 CONECT 38 35 71 CONECT 39 8 5 CONECT 40 1 CONECT 41 1 CONECT 42 1 CONECT 43 6 CONECT 44 9 CONECT 45 13 CONECT 46 14 CONECT 47 14 CONECT 48 14 CONECT 49 15 CONECT 50 16 CONECT 51 16 CONECT 52 17 CONECT 53 17 CONECT 54 18 CONECT 55 18 CONECT 56 20 CONECT 57 20 CONECT 58 20 CONECT 59 27 CONECT 60 30 CONECT 61 31 CONECT 62 32 CONECT 63 32 CONECT 64 33 CONECT 65 36 CONECT 66 36 CONECT 67 36 CONECT 68 37 CONECT 69 37 CONECT 70 37 CONECT 71 38 MASTER 0 0 0 0 0 0 0 0 71 0 144 0 END