HEADER PROTEIN 21-JUN-21 NONE TITLE NULL COMPND NULL SOURCE NULL KEYWDS NULL EXPDTA NULL AUTHOR Marvin REVDAT 1 21-JUN-21 0 HETATM 1 C UNK 0 3.945 2.323 -3.675 0.00 0.00 C+0 HETATM 2 O UNK 0 4.277 2.641 -2.325 0.00 0.00 O+0 HETATM 3 C UNK 0 3.367 2.276 -1.365 0.00 0.00 C+0 HETATM 4 C UNK 0 2.111 1.722 -1.599 0.00 0.00 C+0 HETATM 5 C UNK 0 1.264 1.378 -0.526 0.00 0.00 C+0 HETATM 6 C UNK 0 -0.089 0.730 -0.842 0.00 0.00 C+0 HETATM 7 C UNK 0 -1.226 1.176 0.071 0.00 0.00 C+0 HETATM 8 C UNK 0 -1.694 0.321 1.087 0.00 0.00 C+0 HETATM 9 C UNK 0 -2.717 0.743 1.952 0.00 0.00 C+0 HETATM 10 C UNK 0 -3.290 2.005 1.804 0.00 0.00 C+0 HETATM 11 O UNK 0 -4.305 2.525 2.568 0.00 0.00 O+0 HETATM 12 C UNK 0 -4.834 1.690 3.592 0.00 0.00 C+0 HETATM 13 C UNK 0 -2.823 2.854 0.792 0.00 0.00 C+0 HETATM 14 O UNK 0 -3.422 4.080 0.641 0.00 0.00 O+0 HETATM 15 C UNK 0 -1.787 2.461 -0.060 0.00 0.00 C+0 HETATM 16 O UNK 0 -1.314 3.241 -1.085 0.00 0.00 O+0 HETATM 17 C UNK 0 -0.928 4.551 -0.673 0.00 0.00 C+0 HETATM 18 C UNK 0 -1.102 -1.009 1.272 0.00 0.00 C+0 HETATM 19 C UNK 0 -0.297 -1.535 0.337 0.00 0.00 C+0 HETATM 20 C UNK 0 0.265 -2.885 0.600 0.00 0.00 C+0 HETATM 21 O UNK 0 1.018 -3.460 -0.179 0.00 0.00 O+0 HETATM 22 C UNK 0 0.076 -0.820 -0.943 0.00 0.00 C+0 HETATM 23 C UNK 0 -0.765 -1.353 -2.129 0.00 0.00 C+0 HETATM 24 O UNK 0 -0.425 -2.682 -2.530 0.00 0.00 O+0 HETATM 25 C UNK 0 0.839 -2.791 -3.198 0.00 0.00 C+0 HETATM 26 O UNK 0 0.848 -1.979 -4.374 0.00 0.00 O+0 HETATM 27 C UNK 0 2.111 -2.048 -5.062 0.00 0.00 C+0 HETATM 28 C UNK 0 2.071 -1.032 -6.206 0.00 0.00 C+0 HETATM 29 O UNK 0 1.767 0.262 -5.670 0.00 0.00 O+0 HETATM 30 C UNK 0 2.357 -3.473 -5.565 0.00 0.00 C+0 HETATM 31 O UNK 0 3.618 -3.577 -6.228 0.00 0.00 O+0 HETATM 32 C UNK 0 2.331 -4.437 -4.377 0.00 0.00 C+0 HETATM 33 O UNK 0 2.449 -5.784 -4.864 0.00 0.00 O+0 HETATM 34 C UNK 0 1.053 -4.278 -3.552 0.00 0.00 C+0 HETATM 35 O UNK 0 1.182 -5.123 -2.395 0.00 0.00 O+0 HETATM 36 C UNK 0 1.706 1.596 0.792 0.00 0.00 C+0 HETATM 37 C UNK 0 2.956 2.170 1.044 0.00 0.00 C+0 HETATM 38 O UNK 0 3.465 2.428 2.290 0.00 0.00 O+0 HETATM 39 C UNK 0 2.587 2.285 3.397 0.00 0.00 C+0 HETATM 40 C UNK 0 3.774 2.499 -0.043 0.00 0.00 C+0 HETATM 41 O UNK 0 5.011 3.055 0.181 0.00 0.00 O+0 HETATM 42 H UNK 0 4.784 2.633 -4.306 0.00 0.00 H+0 HETATM 43 H UNK 0 3.059 2.877 -4.003 0.00 0.00 H+0 HETATM 44 H UNK 0 3.812 1.244 -3.804 0.00 0.00 H+0 HETATM 45 H UNK 0 1.764 1.547 -2.613 0.00 0.00 H+0 HETATM 46 H UNK 0 -0.362 1.090 -1.845 0.00 0.00 H+0 HETATM 47 H UNK 0 -3.058 0.066 2.729 0.00 0.00 H+0 HETATM 48 H UNK 0 -4.071 1.454 4.341 0.00 0.00 H+0 HETATM 49 H UNK 0 -5.633 2.244 4.094 0.00 0.00 H+0 HETATM 50 H UNK 0 -5.273 0.779 3.171 0.00 0.00 H+0 HETATM 51 H UNK 0 -4.127 4.109 1.317 0.00 0.00 H+0 HETATM 52 H UNK 0 -1.756 5.252 -0.813 0.00 0.00 H+0 HETATM 53 H UNK 0 -0.563 4.580 0.361 0.00 0.00 H+0 HETATM 54 H UNK 0 -0.109 4.874 -1.323 0.00 0.00 H+0 HETATM 55 H UNK 0 -1.355 -1.545 2.183 0.00 0.00 H+0 HETATM 56 H UNK 0 -0.036 -3.356 1.551 0.00 0.00 H+0 HETATM 57 H UNK 0 1.132 -1.031 -1.142 0.00 0.00 H+0 HETATM 58 H UNK 0 -0.689 -0.694 -3.001 0.00 0.00 H+0 HETATM 59 H UNK 0 -1.826 -1.370 -1.854 0.00 0.00 H+0 HETATM 60 H UNK 0 1.637 -2.467 -2.522 0.00 0.00 H+0 HETATM 61 H UNK 0 2.902 -1.733 -4.367 0.00 0.00 H+0 HETATM 62 H UNK 0 3.031 -0.970 -6.727 0.00 0.00 H+0 HETATM 63 H UNK 0 1.288 -1.277 -6.931 0.00 0.00 H+0 HETATM 64 H UNK 0 0.922 0.141 -5.196 0.00 0.00 H+0 HETATM 65 H UNK 0 1.584 -3.765 -6.287 0.00 0.00 H+0 HETATM 66 H UNK 0 3.773 -4.539 -6.333 0.00 0.00 H+0 HETATM 67 H UNK 0 3.214 -4.277 -3.745 0.00 0.00 H+0 HETATM 68 H UNK 0 2.233 -6.347 -4.091 0.00 0.00 H+0 HETATM 69 H UNK 0 0.193 -4.659 -4.115 0.00 0.00 H+0 HETATM 70 H UNK 0 0.919 -4.589 -1.611 0.00 0.00 H+0 HETATM 71 H UNK 0 1.061 1.311 1.615 0.00 0.00 H+0 HETATM 72 H UNK 0 3.119 2.622 4.291 0.00 0.00 H+0 HETATM 73 H UNK 0 1.696 2.912 3.283 0.00 0.00 H+0 HETATM 74 H UNK 0 2.315 1.236 3.548 0.00 0.00 H+0 HETATM 75 H UNK 0 5.389 3.199 -0.708 0.00 0.00 H+0 CONECT 1 2 42 43 44 CONECT 2 3 1 CONECT 3 40 2 4 CONECT 4 3 5 45 CONECT 5 6 36 4 CONECT 6 22 5 7 46 CONECT 7 8 15 6 CONECT 8 7 9 18 CONECT 9 8 10 47 CONECT 10 11 13 9 CONECT 11 10 12 CONECT 12 11 48 49 50 CONECT 13 15 14 10 CONECT 14 13 51 CONECT 15 16 13 7 CONECT 16 15 17 CONECT 17 16 52 53 54 CONECT 18 19 8 55 CONECT 19 22 18 20 CONECT 20 19 21 56 CONECT 21 20 CONECT 22 6 19 23 57 CONECT 23 22 24 58 59 CONECT 24 23 25 CONECT 25 24 26 34 60 CONECT 26 25 27 CONECT 27 26 30 28 61 CONECT 28 27 29 62 63 CONECT 29 28 64 CONECT 30 27 32 31 65 CONECT 31 30 66 CONECT 32 30 34 33 67 CONECT 33 32 68 CONECT 34 25 32 35 69 CONECT 35 34 70 CONECT 36 5 37 71 CONECT 37 36 40 38 CONECT 38 37 39 CONECT 39 38 72 73 74 CONECT 40 37 41 3 CONECT 41 40 75 CONECT 42 1 CONECT 43 1 CONECT 44 1 CONECT 45 4 CONECT 46 6 CONECT 47 9 CONECT 48 12 CONECT 49 12 CONECT 50 12 CONECT 51 14 CONECT 52 17 CONECT 53 17 CONECT 54 17 CONECT 55 18 CONECT 56 20 CONECT 57 22 CONECT 58 23 CONECT 59 23 CONECT 60 25 CONECT 61 27 CONECT 62 28 CONECT 63 28 CONECT 64 29 CONECT 65 30 CONECT 66 31 CONECT 67 32 CONECT 68 33 CONECT 69 34 CONECT 70 35 CONECT 71 36 CONECT 72 39 CONECT 73 39 CONECT 74 39 CONECT 75 41 MASTER 0 0 0 0 0 0 0 0 75 0 156 0 END