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 9.549 0.157 0.822 0.00 0.00 C+0 HETATM 2 C UNK 0 9.085 -0.814 -0.180 0.00 0.00 C+0 HETATM 3 C UNK 0 9.917 -1.481 -1.152 0.00 0.00 C+0 HETATM 4 C UNK 0 11.160 -1.447 -1.378 0.00 0.00 C+0 HETATM 5 C UNK 0 12.312 -0.788 -0.834 0.00 0.00 C+0 HETATM 6 O UNK 0 13.453 -1.068 -1.427 0.00 0.00 O+0 HETATM 7 O UNK 0 12.392 0.088 0.215 0.00 0.00 O+0 HETATM 8 C UNK 0 7.747 -1.106 -0.203 0.00 0.00 C+0 HETATM 9 C UNK 0 6.769 -0.535 0.682 0.00 0.00 C+0 HETATM 10 C UNK 0 5.813 0.402 -0.007 0.00 0.00 C+0 HETATM 11 O UNK 0 6.526 1.435 -0.620 0.00 0.00 O+0 HETATM 12 C UNK 0 4.797 -0.270 -0.824 0.00 0.00 C+0 HETATM 13 C UNK 0 5.244 -1.113 -1.967 0.00 0.00 C+0 HETATM 14 C UNK 0 3.703 0.698 -1.293 0.00 0.00 C+0 HETATM 15 O UNK 0 4.210 1.734 -2.060 0.00 0.00 O+0 HETATM 16 C UNK 0 2.975 1.245 -0.139 0.00 0.00 C+0 HETATM 17 C UNK 0 1.698 0.942 0.089 0.00 0.00 C+0 HETATM 18 C UNK 0 0.969 1.479 1.228 0.00 0.00 C+0 HETATM 19 C UNK 0 -0.276 1.224 1.503 0.00 0.00 C+0 HETATM 20 C UNK 0 -1.134 0.354 0.706 0.00 0.00 C+0 HETATM 21 C UNK 0 -2.367 0.172 1.065 0.00 0.00 C+0 HETATM 22 C UNK 0 -3.386 -0.672 0.384 0.00 0.00 C+0 HETATM 23 C UNK 0 -3.796 -1.670 1.401 0.00 0.00 C+0 HETATM 24 C UNK 0 -3.227 -3.040 1.302 0.00 0.00 C+0 HETATM 25 C UNK 0 -4.629 -1.281 2.323 0.00 0.00 C+0 HETATM 26 C UNK 0 -5.173 0.054 2.408 0.00 0.00 C+0 HETATM 27 C UNK 0 -5.098 0.937 1.194 0.00 0.00 C+0 HETATM 28 C UNK 0 -4.534 0.285 0.010 0.00 0.00 C+0 HETATM 29 C UNK 0 -3.918 1.152 -1.066 0.00 0.00 C+0 HETATM 30 O UNK 0 -4.791 2.130 -1.548 0.00 0.00 O+0 HETATM 31 C UNK 0 -3.543 0.262 -2.246 0.00 0.00 C+0 HETATM 32 C UNK 0 -2.248 0.171 -2.641 0.00 0.00 C+0 HETATM 33 C UNK 0 -1.907 -0.671 -3.717 0.00 0.00 C+0 HETATM 34 C UNK 0 -2.889 -1.405 -4.371 0.00 0.00 C+0 HETATM 35 O UNK 0 -2.563 -2.252 -5.448 0.00 0.00 O+0 HETATM 36 C UNK 0 -4.215 -1.312 -3.967 0.00 0.00 C+0 HETATM 37 C UNK 0 -4.518 -0.468 -2.897 0.00 0.00 C+0 HETATM 38 C UNK 0 -6.398 1.577 1.213 0.00 0.00 C+0 HETATM 39 C UNK 0 -6.353 2.650 2.338 0.00 0.00 C+0 HETATM 40 C UNK 0 -7.026 2.252 0.068 0.00 0.00 C+0 HETATM 41 C UNK 0 -7.441 0.573 1.735 0.00 0.00 C+0 HETATM 42 C UNK 0 -6.649 -0.114 2.785 0.00 0.00 C+0 HETATM 43 C UNK 0 -7.064 -1.582 2.753 0.00 0.00 C+0 HETATM 44 O UNK 0 -6.908 0.322 4.087 0.00 0.00 O+0 HETATM 45 H UNK 0 10.052 0.978 0.233 0.00 0.00 H+0 HETATM 46 H UNK 0 8.689 0.670 1.328 0.00 0.00 H+0 HETATM 47 H UNK 0 10.197 -0.328 1.567 0.00 0.00 H+0 HETATM 48 H UNK 0 9.331 -2.162 -1.843 0.00 0.00 H+0 HETATM 49 H UNK 0 11.476 -2.133 -2.267 0.00 0.00 H+0 HETATM 50 H UNK 0 12.488 1.097 0.063 0.00 0.00 H+0 HETATM 51 H UNK 0 7.469 -1.859 -0.964 0.00 0.00 H+0 HETATM 52 H UNK 0 6.098 -1.419 1.099 0.00 0.00 H+0 HETATM 53 H UNK 0 7.105 -0.041 1.598 0.00 0.00 H+0 HETATM 54 H UNK 0 5.194 0.938 0.832 0.00 0.00 H+0 HETATM 55 H UNK 0 6.859 1.218 -1.504 0.00 0.00 H+0 HETATM 56 H UNK 0 4.245 -0.984 -0.126 0.00 0.00 H+0 HETATM 57 H UNK 0 5.336 -2.192 -1.730 0.00 0.00 H+0 HETATM 58 H UNK 0 6.136 -0.776 -2.504 0.00 0.00 H+0 HETATM 59 H UNK 0 4.430 -1.077 -2.762 0.00 0.00 H+0 HETATM 60 H UNK 0 2.995 0.060 -1.904 0.00 0.00 H+0 HETATM 61 H UNK 0 3.439 2.034 -2.637 0.00 0.00 H+0 HETATM 62 H UNK 0 3.450 1.904 0.546 0.00 0.00 H+0 HETATM 63 H UNK 0 1.214 0.282 -0.598 0.00 0.00 H+0 HETATM 64 H UNK 0 1.524 2.146 1.894 0.00 0.00 H+0 HETATM 65 H UNK 0 -0.697 1.707 2.406 0.00 0.00 H+0 HETATM 66 H UNK 0 -0.719 -0.127 -0.149 0.00 0.00 H+0 HETATM 67 H UNK 0 -2.770 0.661 1.974 0.00 0.00 H+0 HETATM 68 H UNK 0 -2.994 -1.167 -0.528 0.00 0.00 H+0 HETATM 69 H UNK 0 -2.156 -2.961 1.099 0.00 0.00 H+0 HETATM 70 H UNK 0 -3.335 -3.547 2.285 0.00 0.00 H+0 HETATM 71 H UNK 0 -3.759 -3.650 0.536 0.00 0.00 H+0 HETATM 72 H UNK 0 -4.929 -2.007 3.072 0.00 0.00 H+0 HETATM 73 H UNK 0 -4.721 0.575 3.273 0.00 0.00 H+0 HETATM 74 H UNK 0 -4.336 1.763 1.471 0.00 0.00 H+0 HETATM 75 H UNK 0 -5.346 -0.311 -0.502 0.00 0.00 H+0 HETATM 76 H UNK 0 -2.989 1.658 -0.797 0.00 0.00 H+0 HETATM 77 H UNK 0 -4.320 2.917 -1.896 0.00 0.00 H+0 HETATM 78 H UNK 0 -1.484 0.754 -2.145 0.00 0.00 H+0 HETATM 79 H UNK 0 -0.876 -0.746 -4.036 0.00 0.00 H+0 HETATM 80 H UNK 0 -1.619 -2.345 -5.768 0.00 0.00 H+0 HETATM 81 H UNK 0 -4.986 -1.892 -4.486 0.00 0.00 H+0 HETATM 82 H UNK 0 -5.549 -0.378 -2.562 0.00 0.00 H+0 HETATM 83 H UNK 0 -7.327 3.101 2.503 0.00 0.00 H+0 HETATM 84 H UNK 0 -5.918 2.221 3.248 0.00 0.00 H+0 HETATM 85 H UNK 0 -5.593 3.405 1.975 0.00 0.00 H+0 HETATM 86 H UNK 0 -7.282 1.654 -0.812 0.00 0.00 H+0 HETATM 87 H UNK 0 -8.091 2.507 0.464 0.00 0.00 H+0 HETATM 88 H UNK 0 -6.658 3.282 -0.127 0.00 0.00 H+0 HETATM 89 H UNK 0 -8.252 1.165 2.229 0.00 0.00 H+0 HETATM 90 H UNK 0 -7.787 -0.054 0.915 0.00 0.00 H+0 HETATM 91 H UNK 0 -8.161 -1.587 2.570 0.00 0.00 H+0 HETATM 92 H UNK 0 -6.592 -2.103 1.902 0.00 0.00 H+0 HETATM 93 H UNK 0 -6.913 -2.066 3.736 0.00 0.00 H+0 HETATM 94 H UNK 0 -7.835 0.009 4.286 0.00 0.00 H+0 CONECT 1 2 45 46 47 CONECT 2 1 3 8 CONECT 3 2 4 48 CONECT 4 3 5 49 CONECT 5 4 6 7 CONECT 6 5 CONECT 7 5 50 CONECT 8 2 9 51 CONECT 9 8 10 52 53 CONECT 10 9 11 12 54 CONECT 11 10 55 CONECT 12 10 13 14 56 CONECT 13 12 57 58 59 CONECT 14 12 15 16 60 CONECT 15 14 61 CONECT 16 14 17 62 CONECT 17 16 18 63 CONECT 18 17 19 64 CONECT 19 18 20 65 CONECT 20 19 21 66 CONECT 21 20 22 67 CONECT 22 21 23 28 68 CONECT 23 22 24 25 CONECT 24 23 69 70 71 CONECT 25 23 26 72 CONECT 26 25 27 42 73 CONECT 27 26 28 38 74 CONECT 28 27 29 22 75 CONECT 29 28 30 31 76 CONECT 30 29 77 CONECT 31 29 32 37 CONECT 32 31 33 78 CONECT 33 32 34 79 CONECT 34 33 35 36 CONECT 35 34 80 CONECT 36 34 37 81 CONECT 37 36 31 82 CONECT 38 27 39 40 41 CONECT 39 38 83 84 85 CONECT 40 38 86 87 88 CONECT 41 38 42 89 90 CONECT 42 41 43 44 26 CONECT 43 42 91 92 93 CONECT 44 42 94 CONECT 45 1 CONECT 46 1 CONECT 47 1 CONECT 48 3 CONECT 49 4 CONECT 50 7 CONECT 51 8 CONECT 52 9 CONECT 53 9 CONECT 54 10 CONECT 55 11 CONECT 56 12 CONECT 57 13 CONECT 58 13 CONECT 59 13 CONECT 60 14 CONECT 61 15 CONECT 62 16 CONECT 63 17 CONECT 64 18 CONECT 65 19 CONECT 66 20 CONECT 67 21 CONECT 68 22 CONECT 69 24 CONECT 70 24 CONECT 71 24 CONECT 72 25 CONECT 73 26 CONECT 74 27 CONECT 75 28 CONECT 76 29 CONECT 77 30 CONECT 78 32 CONECT 79 33 CONECT 80 35 CONECT 81 36 CONECT 82 37 CONECT 83 39 CONECT 84 39 CONECT 85 39 CONECT 86 40 CONECT 87 40 CONECT 88 40 CONECT 89 41 CONECT 90 41 CONECT 91 43 CONECT 92 43 CONECT 93 43 CONECT 94 44 MASTER 0 0 0 0 0 0 0 0 94 0 192 0 END