HEADER PROTEIN 04-JUL-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 04-JUL-21 0 HETATM 1 C UNK 0 8.933 0.928 0.486 0.00 0.00 C+0 HETATM 2 N UNK 0 8.090 -0.194 0.120 0.00 0.00 N+0 HETATM 3 C UNK 0 6.995 -0.361 1.053 0.00 0.00 C+0 HETATM 4 C UNK 0 6.088 0.843 1.046 0.00 0.00 C+0 HETATM 5 O UNK 0 5.104 0.729 2.006 0.00 0.00 O+0 HETATM 6 C UNK 0 4.301 -0.354 1.754 0.00 0.00 C+0 HETATM 7 O UNK 0 3.543 -0.239 0.581 0.00 0.00 O+0 HETATM 8 C UNK 0 2.200 -0.298 0.856 0.00 0.00 C+0 HETATM 9 C UNK 0 1.338 -0.201 -0.349 0.00 0.00 C+0 HETATM 10 O UNK 0 -0.016 -0.278 -0.005 0.00 0.00 O+0 HETATM 11 C UNK 0 -0.655 -0.742 -1.177 0.00 0.00 C+0 HETATM 12 N UNK 0 -1.939 -1.323 -0.940 0.00 0.00 N+0 HETATM 13 C UNK 0 -2.295 -2.621 -1.163 0.00 0.00 C+0 HETATM 14 C UNK 0 -1.610 -3.693 -1.673 0.00 0.00 C+0 HETATM 15 Cl UNK 0 0.035 -3.634 -2.217 0.00 0.00 Cl+0 HETATM 16 C UNK 0 -2.218 -4.951 -1.804 0.00 0.00 C+0 HETATM 17 C UNK 0 -3.517 -5.155 -1.428 0.00 0.00 C+0 HETATM 18 C UNK 0 -4.183 -4.045 -0.916 0.00 0.00 C+0 HETATM 19 C UNK 0 -3.619 -2.803 -0.774 0.00 0.00 C+0 HETATM 20 C UNK 0 -4.046 -1.563 -0.311 0.00 0.00 C+0 HETATM 21 C UNK 0 -5.285 -1.159 0.201 0.00 0.00 C+0 HETATM 22 C UNK 0 -5.437 0.185 0.599 0.00 0.00 C+0 HETATM 23 C UNK 0 -4.383 1.081 0.483 0.00 0.00 C+0 HETATM 24 C UNK 0 -4.263 2.431 0.782 0.00 0.00 C+0 HETATM 25 C UNK 0 -5.090 3.400 1.298 0.00 0.00 C+0 HETATM 26 C UNK 0 -4.661 4.707 1.482 0.00 0.00 C+0 HETATM 27 C UNK 0 -3.379 5.075 1.149 0.00 0.00 C+0 HETATM 28 C UNK 0 -2.559 4.096 0.634 0.00 0.00 C+0 HETATM 29 C UNK 0 -2.976 2.787 0.445 0.00 0.00 C+0 HETATM 30 N UNK 0 -2.330 1.693 -0.044 0.00 0.00 N+0 HETATM 31 C UNK 0 -3.163 0.669 -0.024 0.00 0.00 C+0 HETATM 32 C UNK 0 -3.012 -0.659 -0.416 0.00 0.00 C+0 HETATM 33 C UNK 0 -6.785 0.354 1.089 0.00 0.00 C+0 HETATM 34 O UNK 0 -7.350 1.365 1.537 0.00 0.00 O+0 HETATM 35 N UNK 0 -7.443 -0.928 0.975 0.00 0.00 N+0 HETATM 36 C UNK 0 -8.811 -1.171 1.368 0.00 0.00 C+0 HETATM 37 C UNK 0 -6.522 -1.855 0.431 0.00 0.00 C+0 HETATM 38 O UNK 0 -6.835 -3.033 0.230 0.00 0.00 O+0 HETATM 39 C UNK 0 -0.521 0.143 -2.362 0.00 0.00 C+0 HETATM 40 O UNK 0 -0.471 -0.624 -3.554 0.00 0.00 O+0 HETATM 41 C UNK 0 0.607 1.097 -2.344 0.00 0.00 C+0 HETATM 42 O UNK 0 0.176 2.426 -2.551 0.00 0.00 O+0 HETATM 43 C UNK 0 1.504 1.056 -1.138 0.00 0.00 C+0 HETATM 44 O UNK 0 2.841 1.285 -1.473 0.00 0.00 O+0 HETATM 45 C UNK 0 3.354 2.435 -0.919 0.00 0.00 C+0 HETATM 46 C UNK 0 5.072 -1.667 1.765 0.00 0.00 C+0 HETATM 47 C UNK 0 6.151 -1.563 0.688 0.00 0.00 C+0 HETATM 48 O UNK 0 6.897 -2.736 0.677 0.00 0.00 O+0 HETATM 49 H UNK 0 8.429 1.848 0.089 0.00 0.00 H+0 HETATM 50 H UNK 0 8.973 0.986 1.604 0.00 0.00 H+0 HETATM 51 H UNK 0 9.944 0.847 0.074 0.00 0.00 H+0 HETATM 52 H UNK 0 7.678 0.024 -0.825 0.00 0.00 H+0 HETATM 53 H UNK 0 7.445 -0.475 2.064 0.00 0.00 H+0 HETATM 54 H UNK 0 6.699 1.774 1.185 0.00 0.00 H+0 HETATM 55 H UNK 0 5.575 0.846 0.048 0.00 0.00 H+0 HETATM 56 H UNK 0 3.573 -0.457 2.610 0.00 0.00 H+0 HETATM 57 H UNK 0 1.895 0.421 1.666 0.00 0.00 H+0 HETATM 58 H UNK 0 2.002 -1.310 1.317 0.00 0.00 H+0 HETATM 59 H UNK 0 1.581 -1.083 -1.010 0.00 0.00 H+0 HETATM 60 H UNK 0 0.048 -1.605 -1.424 0.00 0.00 H+0 HETATM 61 H UNK 0 -1.679 -5.795 -2.205 0.00 0.00 H+0 HETATM 62 H UNK 0 -4.016 -6.112 -1.516 0.00 0.00 H+0 HETATM 63 H UNK 0 -5.187 -4.224 -0.632 0.00 0.00 H+0 HETATM 64 H UNK 0 -6.078 3.185 1.570 0.00 0.00 H+0 HETATM 65 H UNK 0 -5.321 5.457 1.889 0.00 0.00 H+0 HETATM 66 H UNK 0 -3.046 6.109 1.298 0.00 0.00 H+0 HETATM 67 H UNK 0 -1.539 4.416 0.375 0.00 0.00 H+0 HETATM 68 H UNK 0 -1.370 1.786 -0.348 0.00 0.00 H+0 HETATM 69 H UNK 0 -8.988 -0.789 2.417 0.00 0.00 H+0 HETATM 70 H UNK 0 -9.548 -0.695 0.679 0.00 0.00 H+0 HETATM 71 H UNK 0 -9.034 -2.256 1.392 0.00 0.00 H+0 HETATM 72 H UNK 0 -1.472 0.737 -2.505 0.00 0.00 H+0 HETATM 73 H UNK 0 -0.269 -0.031 -4.318 0.00 0.00 H+0 HETATM 74 H UNK 0 1.283 0.901 -3.227 0.00 0.00 H+0 HETATM 75 H UNK 0 0.267 2.968 -1.733 0.00 0.00 H+0 HETATM 76 H UNK 0 1.208 1.905 -0.482 0.00 0.00 H+0 HETATM 77 H UNK 0 4.423 2.491 -1.267 0.00 0.00 H+0 HETATM 78 H UNK 0 3.382 2.472 0.174 0.00 0.00 H+0 HETATM 79 H UNK 0 2.886 3.360 -1.316 0.00 0.00 H+0 HETATM 80 H UNK 0 4.344 -2.459 1.542 0.00 0.00 H+0 HETATM 81 H UNK 0 5.580 -1.740 2.731 0.00 0.00 H+0 HETATM 82 H UNK 0 5.649 -1.353 -0.271 0.00 0.00 H+0 HETATM 83 H UNK 0 6.829 -3.090 -0.256 0.00 0.00 H+0 CONECT 1 2 49 50 51 CONECT 2 1 3 52 CONECT 3 2 4 47 53 CONECT 4 3 5 54 55 CONECT 5 4 6 CONECT 6 5 7 46 56 CONECT 7 6 8 CONECT 8 7 9 57 58 CONECT 9 8 10 43 59 CONECT 10 9 11 CONECT 11 10 12 39 60 CONECT 12 11 13 32 CONECT 13 12 14 19 CONECT 14 13 15 16 CONECT 15 14 CONECT 16 14 17 61 CONECT 17 16 18 62 CONECT 18 17 19 63 CONECT 19 18 20 13 CONECT 20 19 21 32 CONECT 21 20 22 37 CONECT 22 21 23 33 CONECT 23 22 24 31 CONECT 24 23 25 29 CONECT 25 24 26 64 CONECT 26 25 27 65 CONECT 27 26 28 66 CONECT 28 27 29 67 CONECT 29 28 30 24 CONECT 30 29 31 68 CONECT 31 30 32 23 CONECT 32 31 12 20 CONECT 33 22 34 35 CONECT 34 33 CONECT 35 33 36 37 CONECT 36 35 69 70 71 CONECT 37 35 38 21 CONECT 38 37 CONECT 39 11 40 41 72 CONECT 40 39 73 CONECT 41 39 42 43 74 CONECT 42 41 75 CONECT 43 41 44 9 76 CONECT 44 43 45 CONECT 45 44 77 78 79 CONECT 46 6 47 80 81 CONECT 47 46 48 3 82 CONECT 48 47 83 CONECT 49 1 CONECT 50 1 CONECT 51 1 CONECT 52 2 CONECT 53 3 CONECT 54 4 CONECT 55 4 CONECT 56 6 CONECT 57 8 CONECT 58 8 CONECT 59 9 CONECT 60 11 CONECT 61 16 CONECT 62 17 CONECT 63 18 CONECT 64 25 CONECT 65 26 CONECT 66 27 CONECT 67 28 CONECT 68 30 CONECT 69 36 CONECT 70 36 CONECT 71 36 CONECT 72 39 CONECT 73 40 CONECT 74 41 CONECT 75 42 CONECT 76 43 CONECT 77 45 CONECT 78 45 CONECT 79 45 CONECT 80 46 CONECT 81 46 CONECT 82 47 CONECT 83 48 MASTER 0 0 0 0 0 0 0 0 83 0 180 0 END