HEADER PROTEIN 01-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 01-JUL-21 0 HETATM 1 C UNK 0 -8.226 0.478 -0.756 0.00 0.00 C+0 HETATM 2 C UNK 0 -7.020 0.444 -0.239 0.00 0.00 C+0 HETATM 3 C UNK 0 -5.917 -0.467 -0.635 0.00 0.00 C+0 HETATM 4 C UNK 0 -4.644 0.341 -0.482 0.00 0.00 C+0 HETATM 5 O UNK 0 -4.814 1.546 -1.128 0.00 0.00 O+0 HETATM 6 C UNK 0 -5.096 1.486 -2.463 0.00 0.00 C+0 HETATM 7 C UNK 0 -3.461 -0.389 -1.057 0.00 0.00 C+0 HETATM 8 O UNK 0 -3.244 -1.618 -0.432 0.00 0.00 O+0 HETATM 9 C UNK 0 -2.210 0.390 -0.970 0.00 0.00 C+0 HETATM 10 O UNK 0 -2.147 1.558 -1.430 0.00 0.00 O+0 HETATM 11 N UNK 0 -1.070 -0.175 -0.369 0.00 0.00 N+0 HETATM 12 C UNK 0 0.200 0.564 -0.265 0.00 0.00 C+0 HETATM 13 O UNK 0 0.512 0.630 1.083 0.00 0.00 O+0 HETATM 14 C UNK 0 0.491 1.925 1.583 0.00 0.00 C+0 HETATM 15 C UNK 0 1.253 -0.118 -1.090 0.00 0.00 C+0 HETATM 16 C UNK 0 1.233 -1.605 -0.805 0.00 0.00 C+0 HETATM 17 C UNK 0 2.508 -2.155 -1.420 0.00 0.00 C+0 HETATM 18 O UNK 0 2.656 -1.605 -2.689 0.00 0.00 O+0 HETATM 19 C UNK 0 3.684 -1.607 -0.586 0.00 0.00 C+0 HETATM 20 C UNK 0 3.622 -2.421 0.711 0.00 0.00 C+0 HETATM 21 C UNK 0 4.936 -2.012 -1.278 0.00 0.00 C+0 HETATM 22 C UNK 0 3.489 -0.146 -0.362 0.00 0.00 C+0 HETATM 23 C UNK 0 4.680 0.723 -0.535 0.00 0.00 C+0 HETATM 24 C UNK 0 5.862 0.488 0.353 0.00 0.00 C+0 HETATM 25 C UNK 0 6.897 1.546 -0.116 0.00 0.00 C+0 HETATM 26 O UNK 0 8.070 1.483 0.608 0.00 0.00 O+0 HETATM 27 C UNK 0 8.775 0.321 0.511 0.00 0.00 C+0 HETATM 28 O UNK 0 5.526 0.710 1.657 0.00 0.00 O+0 HETATM 29 C UNK 0 5.859 -0.181 2.607 0.00 0.00 C+0 HETATM 30 O UNK 0 2.479 0.434 -1.104 0.00 0.00 O+0 HETATM 31 O UNK 0 -4.369 0.633 0.841 0.00 0.00 O+0 HETATM 32 C UNK 0 -5.465 0.855 1.630 0.00 0.00 C+0 HETATM 33 C UNK 0 -5.866 -0.341 2.466 0.00 0.00 C+0 HETATM 34 C UNK 0 -6.678 1.393 0.854 0.00 0.00 C+0 HETATM 35 C UNK 0 -7.826 1.547 1.825 0.00 0.00 C+0 HETATM 36 H UNK 0 -8.950 1.195 -0.377 0.00 0.00 H+0 HETATM 37 H UNK 0 -8.607 -0.157 -1.555 0.00 0.00 H+0 HETATM 38 H UNK 0 -6.053 -0.764 -1.667 0.00 0.00 H+0 HETATM 39 H UNK 0 -5.895 -1.391 -0.025 0.00 0.00 H+0 HETATM 40 H UNK 0 -6.022 0.942 -2.733 0.00 0.00 H+0 HETATM 41 H UNK 0 -5.273 2.529 -2.867 0.00 0.00 H+0 HETATM 42 H UNK 0 -4.284 1.085 -3.097 0.00 0.00 H+0 HETATM 43 H UNK 0 -3.681 -0.635 -2.127 0.00 0.00 H+0 HETATM 44 H UNK 0 -4.056 -2.188 -0.620 0.00 0.00 H+0 HETATM 45 H UNK 0 -1.038 -1.135 0.040 0.00 0.00 H+0 HETATM 46 H UNK 0 0.010 1.592 -0.640 0.00 0.00 H+0 HETATM 47 H UNK 0 1.227 2.586 1.047 0.00 0.00 H+0 HETATM 48 H UNK 0 0.891 1.848 2.635 0.00 0.00 H+0 HETATM 49 H UNK 0 -0.519 2.361 1.643 0.00 0.00 H+0 HETATM 50 H UNK 0 0.867 -0.048 -2.163 0.00 0.00 H+0 HETATM 51 H UNK 0 1.184 -1.820 0.270 0.00 0.00 H+0 HETATM 52 H UNK 0 0.388 -2.127 -1.294 0.00 0.00 H+0 HETATM 53 H UNK 0 2.532 -3.257 -1.464 0.00 0.00 H+0 HETATM 54 H UNK 0 2.760 -2.254 -3.403 0.00 0.00 H+0 HETATM 55 H UNK 0 2.867 -3.225 0.677 0.00 0.00 H+0 HETATM 56 H UNK 0 4.593 -2.915 0.931 0.00 0.00 H+0 HETATM 57 H UNK 0 3.292 -1.745 1.551 0.00 0.00 H+0 HETATM 58 H UNK 0 5.642 -2.575 -0.623 0.00 0.00 H+0 HETATM 59 H UNK 0 4.682 -2.743 -2.079 0.00 0.00 H+0 HETATM 60 H UNK 0 5.452 -1.185 -1.836 0.00 0.00 H+0 HETATM 61 H UNK 0 3.161 -0.034 0.714 0.00 0.00 H+0 HETATM 62 H UNK 0 4.306 1.784 -0.364 0.00 0.00 H+0 HETATM 63 H UNK 0 4.990 0.776 -1.627 0.00 0.00 H+0 HETATM 64 H UNK 0 6.346 -0.492 0.270 0.00 0.00 H+0 HETATM 65 H UNK 0 7.149 1.289 -1.166 0.00 0.00 H+0 HETATM 66 H UNK 0 6.438 2.541 -0.128 0.00 0.00 H+0 HETATM 67 H UNK 0 8.282 -0.599 0.827 0.00 0.00 H+0 HETATM 68 H UNK 0 9.216 0.148 -0.498 0.00 0.00 H+0 HETATM 69 H UNK 0 9.673 0.436 1.186 0.00 0.00 H+0 HETATM 70 H UNK 0 5.462 0.221 3.593 0.00 0.00 H+0 HETATM 71 H UNK 0 5.413 -1.182 2.514 0.00 0.00 H+0 HETATM 72 H UNK 0 6.944 -0.353 2.757 0.00 0.00 H+0 HETATM 73 H UNK 0 -5.208 1.666 2.342 0.00 0.00 H+0 HETATM 74 H UNK 0 -6.054 -0.084 3.530 0.00 0.00 H+0 HETATM 75 H UNK 0 -6.851 -0.764 2.108 0.00 0.00 H+0 HETATM 76 H UNK 0 -5.162 -1.169 2.443 0.00 0.00 H+0 HETATM 77 H UNK 0 -6.406 2.408 0.464 0.00 0.00 H+0 HETATM 78 H UNK 0 -8.496 0.662 1.756 0.00 0.00 H+0 HETATM 79 H UNK 0 -7.455 1.661 2.882 0.00 0.00 H+0 HETATM 80 H UNK 0 -8.437 2.460 1.613 0.00 0.00 H+0 CONECT 1 2 36 37 CONECT 2 1 3 34 CONECT 3 2 4 38 39 CONECT 4 3 5 7 31 CONECT 5 4 6 CONECT 6 5 40 41 42 CONECT 7 4 8 9 43 CONECT 8 7 44 CONECT 9 7 10 11 CONECT 10 9 CONECT 11 9 12 45 CONECT 12 11 13 15 46 CONECT 13 12 14 CONECT 14 13 47 48 49 CONECT 15 12 16 30 50 CONECT 16 15 17 51 52 CONECT 17 16 18 19 53 CONECT 18 17 54 CONECT 19 17 20 21 22 CONECT 20 19 55 56 57 CONECT 21 19 58 59 60 CONECT 22 19 23 30 61 CONECT 23 22 24 62 63 CONECT 24 23 25 28 64 CONECT 25 24 26 65 66 CONECT 26 25 27 CONECT 27 26 67 68 69 CONECT 28 24 29 CONECT 29 28 70 71 72 CONECT 30 22 15 CONECT 31 4 32 CONECT 32 31 33 34 73 CONECT 33 32 74 75 76 CONECT 34 32 35 2 77 CONECT 35 34 78 79 80 CONECT 36 1 CONECT 37 1 CONECT 38 3 CONECT 39 3 CONECT 40 6 CONECT 41 6 CONECT 42 6 CONECT 43 7 CONECT 44 8 CONECT 45 11 CONECT 46 12 CONECT 47 14 CONECT 48 14 CONECT 49 14 CONECT 50 15 CONECT 51 16 CONECT 52 16 CONECT 53 17 CONECT 54 18 CONECT 55 20 CONECT 56 20 CONECT 57 20 CONECT 58 21 CONECT 59 21 CONECT 60 21 CONECT 61 22 CONECT 62 23 CONECT 63 23 CONECT 64 24 CONECT 65 25 CONECT 66 25 CONECT 67 27 CONECT 68 27 CONECT 69 27 CONECT 70 29 CONECT 71 29 CONECT 72 29 CONECT 73 32 CONECT 74 33 CONECT 75 33 CONECT 76 33 CONECT 77 34 CONECT 78 35 CONECT 79 35 CONECT 80 35 MASTER 0 0 0 0 0 0 0 0 80 0 162 0 END