HEADER PROTEIN 30-JUL-19 NONE TITLE NULL COMPND MOLECULE: 393475 SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 30-JUL-19 0 HETATM 1 O UNK 0 24.867 -3.054 0.000 0.00 0.00 O+0 HETATM 2 O UNK 0 28.824 -1.720 0.000 0.00 0.00 O+0 HETATM 3 O UNK 0 21.836 -4.131 0.000 0.00 0.00 O+0 HETATM 4 O UNK 0 31.854 -0.643 0.000 0.00 0.00 O+0 HETATM 5 O UNK 0 16.114 1.021 0.000 0.00 0.00 O+0 HETATM 6 O UNK 0 8.286 2.685 0.000 0.00 0.00 O+0 HETATM 7 O UNK 0 3.080 2.747 0.000 0.00 0.00 O+0 HETATM 8 O UNK 0 3.224 0.006 0.000 0.00 0.00 O+0 HETATM 9 C UNK 0 26.113 -2.149 0.000 0.00 0.00 C+0 HETATM 10 C UNK 0 27.578 -2.625 0.000 0.00 0.00 C+0 HETATM 11 C UNK 0 25.637 -0.684 0.000 0.00 0.00 C+0 HETATM 12 C UNK 0 28.054 -4.090 0.000 0.00 0.00 C+0 HETATM 13 C UNK 0 23.621 -2.149 0.000 0.00 0.00 C+0 HETATM 14 C UNK 0 30.070 -2.625 0.000 0.00 0.00 C+0 HETATM 15 C UNK 0 24.097 -0.684 0.000 0.00 0.00 C+0 HETATM 16 C UNK 0 29.594 -4.090 0.000 0.00 0.00 C+0 HETATM 17 C UNK 0 22.156 -2.625 0.000 0.00 0.00 C+0 HETATM 18 C UNK 0 31.534 -2.149 0.000 0.00 0.00 C+0 HETATM 19 C UNK 0 21.012 -1.594 0.000 0.00 0.00 C+0 HETATM 20 C UNK 0 32.679 -3.179 0.000 0.00 0.00 C+0 HETATM 21 C UNK 0 19.547 -2.070 0.000 0.00 0.00 C+0 HETATM 22 C UNK 0 34.143 -2.703 0.000 0.00 0.00 C+0 HETATM 23 C UNK 0 18.403 -1.040 0.000 0.00 0.00 C+0 HETATM 24 C UNK 0 35.288 -3.734 0.000 0.00 0.00 C+0 HETATM 25 C UNK 0 16.938 -1.516 0.000 0.00 0.00 C+0 HETATM 26 C UNK 0 36.753 -3.258 0.000 0.00 0.00 C+0 HETATM 27 C UNK 0 15.794 -0.485 0.000 0.00 0.00 C+0 HETATM 28 C UNK 0 37.897 -4.289 0.000 0.00 0.00 C+0 HETATM 29 C UNK 0 14.329 -0.961 0.000 0.00 0.00 C+0 HETATM 30 C UNK 0 39.362 -3.813 0.000 0.00 0.00 C+0 HETATM 31 C UNK 0 13.184 0.069 0.000 0.00 0.00 C+0 HETATM 32 C UNK 0 11.720 -0.406 0.000 0.00 0.00 C+0 HETATM 33 C UNK 0 40.506 -4.843 0.000 0.00 0.00 C+0 HETATM 34 C UNK 0 10.575 0.624 0.000 0.00 0.00 C+0 HETATM 35 C UNK 0 9.110 0.148 0.000 0.00 0.00 C+0 HETATM 36 C UNK 0 41.971 -4.367 0.000 0.00 0.00 C+0 HETATM 37 C UNK 0 7.966 1.179 0.000 0.00 0.00 C+0 HETATM 38 C UNK 0 43.116 -5.398 0.000 0.00 0.00 C+0 HETATM 39 C UNK 0 6.501 0.703 0.000 0.00 0.00 C+0 HETATM 40 C UNK 0 5.357 1.733 0.000 0.00 0.00 C+0 HETATM 41 C UNK 0 44.580 -4.922 0.000 0.00 0.00 C+0 HETATM 42 C UNK 0 5.518 3.265 0.000 0.00 0.00 C+0 HETATM 43 C UNK 0 4.111 3.891 0.000 0.00 0.00 C+0 HETATM 44 C UNK 0 3.850 1.413 0.000 0.00 0.00 C+0 HETATM 45 C UNK 0 3.790 5.398 0.000 0.00 0.00 C+0 HETATM 46 H UNK 0 26.262 -3.092 0.000 0.00 0.00 H+0 HETATM 47 H UNK 0 26.902 -3.300 0.000 0.00 0.00 H+0 HETATM 48 H UNK 0 26.571 -0.486 0.000 0.00 0.00 H+0 HETATM 49 H UNK 0 25.537 0.266 0.000 0.00 0.00 H+0 HETATM 50 H UNK 0 27.120 -4.288 0.000 0.00 0.00 H+0 HETATM 51 H UNK 0 28.153 -5.039 0.000 0.00 0.00 H+0 HETATM 52 H UNK 0 23.472 -3.092 0.000 0.00 0.00 H+0 HETATM 53 H UNK 0 30.219 -1.682 0.000 0.00 0.00 H+0 HETATM 54 H UNK 0 24.197 0.266 0.000 0.00 0.00 H+0 HETATM 55 H UNK 0 23.163 -0.486 0.000 0.00 0.00 H+0 HETATM 56 H UNK 0 29.494 -5.039 0.000 0.00 0.00 H+0 HETATM 57 H UNK 0 30.528 -4.288 0.000 0.00 0.00 H+0 HETATM 58 H UNK 0 21.248 -2.920 0.000 0.00 0.00 H+0 HETATM 59 H UNK 0 32.442 -1.854 0.000 0.00 0.00 H+0 HETATM 60 H UNK 0 21.764 -1.006 0.000 0.00 0.00 H+0 HETATM 61 H UNK 0 20.564 -0.751 0.000 0.00 0.00 H+0 HETATM 62 H UNK 0 31.926 -3.767 0.000 0.00 0.00 H+0 HETATM 63 H UNK 0 33.127 -4.023 0.000 0.00 0.00 H+0 HETATM 64 H UNK 0 18.795 -2.658 0.000 0.00 0.00 H+0 HETATM 65 H UNK 0 19.996 -2.913 0.000 0.00 0.00 H+0 HETATM 66 H UNK 0 34.896 -2.116 0.000 0.00 0.00 H+0 HETATM 67 H UNK 0 33.695 -1.860 0.000 0.00 0.00 H+0 HETATM 68 H UNK 0 20.928 -4.426 0.000 0.00 0.00 H+0 HETATM 69 H UNK 0 32.763 -0.347 0.000 0.00 0.00 H+0 HETATM 70 H UNK 0 19.155 -0.452 0.000 0.00 0.00 H+0 HETATM 71 H UNK 0 17.954 -0.197 0.000 0.00 0.00 H+0 HETATM 72 H UNK 0 34.536 -4.322 0.000 0.00 0.00 H+0 HETATM 73 H UNK 0 35.736 -4.577 0.000 0.00 0.00 H+0 HETATM 74 H UNK 0 16.186 -2.103 0.000 0.00 0.00 H+0 HETATM 75 H UNK 0 17.386 -2.359 0.000 0.00 0.00 H+0 HETATM 76 H UNK 0 37.505 -2.670 0.000 0.00 0.00 H+0 HETATM 77 H UNK 0 36.305 -2.415 0.000 0.00 0.00 H+0 HETATM 78 H UNK 0 16.702 -0.190 0.000 0.00 0.00 H+0 HETATM 79 H UNK 0 37.145 -4.877 0.000 0.00 0.00 H+0 HETATM 80 H UNK 0 38.346 -5.132 0.000 0.00 0.00 H+0 HETATM 81 H UNK 0 13.576 -1.549 0.000 0.00 0.00 H+0 HETATM 82 H UNK 0 14.777 -1.804 0.000 0.00 0.00 H+0 HETATM 83 H UNK 0 40.114 -3.225 0.000 0.00 0.00 H+0 HETATM 84 H UNK 0 38.914 -2.970 0.000 0.00 0.00 H+0 HETATM 85 H UNK 0 13.937 0.657 0.000 0.00 0.00 H+0 HETATM 86 H UNK 0 12.736 0.913 0.000 0.00 0.00 H+0 HETATM 87 H UNK 0 10.967 -0.994 0.000 0.00 0.00 H+0 HETATM 88 H UNK 0 12.168 -1.249 0.000 0.00 0.00 H+0 HETATM 89 H UNK 0 39.754 -5.431 0.000 0.00 0.00 H+0 HETATM 90 H UNK 0 40.955 -5.686 0.000 0.00 0.00 H+0 HETATM 91 H UNK 0 15.404 1.660 0.000 0.00 0.00 H+0 HETATM 92 H UNK 0 11.327 1.212 0.000 0.00 0.00 H+0 HETATM 93 H UNK 0 10.127 1.467 0.000 0.00 0.00 H+0 HETATM 94 H UNK 0 8.358 -0.440 0.000 0.00 0.00 H+0 HETATM 95 H UNK 0 9.559 -0.695 0.000 0.00 0.00 H+0 HETATM 96 H UNK 0 42.724 -3.779 0.000 0.00 0.00 H+0 HETATM 97 H UNK 0 41.523 -3.524 0.000 0.00 0.00 H+0 HETATM 98 H UNK 0 8.874 1.474 0.000 0.00 0.00 H+0 HETATM 99 H UNK 0 42.363 -5.986 0.000 0.00 0.00 H+0 HETATM 100 H UNK 0 43.564 -6.241 0.000 0.00 0.00 H+0 HETATM 101 H UNK 0 5.749 0.115 0.000 0.00 0.00 H+0 HETATM 102 H UNK 0 6.949 -0.140 0.000 0.00 0.00 H+0 HETATM 103 H UNK 0 44.875 -5.830 0.000 0.00 0.00 H+0 HETATM 104 H UNK 0 45.489 -4.627 0.000 0.00 0.00 H+0 HETATM 105 H UNK 0 44.285 -4.014 0.000 0.00 0.00 H+0 HETATM 106 H UNK 0 9.194 2.980 0.000 0.00 0.00 H+0 HETATM 107 H UNK 0 6.345 3.742 0.000 0.00 0.00 H+0 HETATM 108 H UNK 0 3.188 4.139 0.000 0.00 0.00 H+0 HETATM 109 H UNK 0 4.725 5.596 0.000 0.00 0.00 H+0 HETATM 110 H UNK 0 3.592 6.332 0.000 0.00 0.00 H+0 HETATM 111 H UNK 0 2.857 5.199 0.000 0.00 0.00 H+0 CONECT 1 9 13 CONECT 2 10 14 CONECT 3 17 68 CONECT 4 18 69 CONECT 5 27 91 CONECT 6 37 106 CONECT 7 43 44 CONECT 8 44 CONECT 9 1 10 11 46 CONECT 10 2 9 12 47 CONECT 11 9 15 48 49 CONECT 12 10 16 50 51 CONECT 13 1 15 17 52 CONECT 14 2 16 18 53 CONECT 15 11 13 54 55 CONECT 16 12 14 56 57 CONECT 17 3 13 19 58 CONECT 18 4 14 20 59 CONECT 19 17 21 60 61 CONECT 20 18 22 62 63 CONECT 21 19 23 64 65 CONECT 22 20 24 66 67 CONECT 23 21 25 70 71 CONECT 24 22 26 72 73 CONECT 25 23 27 74 75 CONECT 26 24 28 76 77 CONECT 27 5 25 29 78 CONECT 28 26 30 79 80 CONECT 29 27 31 81 82 CONECT 30 28 33 83 84 CONECT 31 29 32 85 86 CONECT 32 31 34 87 88 CONECT 33 30 36 89 90 CONECT 34 32 35 92 93 CONECT 35 34 37 94 95 CONECT 36 33 38 96 97 CONECT 37 6 35 39 98 CONECT 38 36 41 99 100 CONECT 39 37 40 101 102 CONECT 40 39 42 44 CONECT 41 38 103 104 105 CONECT 42 40 43 107 CONECT 43 7 42 45 108 CONECT 44 7 8 40 CONECT 45 43 109 110 111 CONECT 46 9 CONECT 47 10 CONECT 48 11 CONECT 49 11 CONECT 50 12 CONECT 51 12 CONECT 52 13 CONECT 53 14 CONECT 54 15 CONECT 55 15 CONECT 56 16 CONECT 57 16 CONECT 58 17 CONECT 59 18 CONECT 60 19 CONECT 61 19 CONECT 62 20 CONECT 63 20 CONECT 64 21 CONECT 65 21 CONECT 66 22 CONECT 67 22 CONECT 68 3 CONECT 69 4 CONECT 70 23 CONECT 71 23 CONECT 72 24 CONECT 73 24 CONECT 74 25 CONECT 75 25 CONECT 76 26 CONECT 77 26 CONECT 78 27 CONECT 79 28 CONECT 80 28 CONECT 81 29 CONECT 82 29 CONECT 83 30 CONECT 84 30 CONECT 85 31 CONECT 86 31 CONECT 87 32 CONECT 88 32 CONECT 89 33 CONECT 90 33 CONECT 91 5 CONECT 92 34 CONECT 93 34 CONECT 94 35 CONECT 95 35 CONECT 96 36 CONECT 97 36 CONECT 98 37 CONECT 99 38 CONECT 100 38 CONECT 101 39 CONECT 102 39 CONECT 103 41 CONECT 104 41 CONECT 105 41 CONECT 106 6 CONECT 107 42 CONECT 108 43 CONECT 109 45 CONECT 110 45 CONECT 111 45 MASTER 0 0 0 0 0 0 0 0 111 0 226 0 END