HEADER Model coordinates for PDB-CCD HZ0 COMPND HZ0 AUTHOR pdbccdutils 0.8.6 AUTHOR RDKit 2023.09.6 HETATM 1 C10 HZ0 A 1 26.709 27.438 46.039 1.00 20.00 C HETATM 2 C15 HZ0 A 1 25.361 27.962 43.599 1.00 20.00 C HETATM 3 C17 HZ0 A 1 25.270 26.664 44.165 1.00 20.00 C HETATM 4 C20 HZ0 A 1 23.064 25.582 43.545 1.00 20.00 C HETATM 5 C21 HZ0 A 1 25.188 24.419 42.973 1.00 20.00 C HETATM 6 C24 HZ0 A 1 27.242 22.981 42.850 1.00 20.00 C HETATM 7 C26 HZ0 A 1 26.097 21.554 44.228 1.00 20.00 C HETATM 8 C28 HZ0 A 1 25.367 21.506 45.576 1.00 20.00 C HETATM 9 C01 HZ0 A 1 31.934 20.801 49.599 1.00 20.00 C HETATM 10 O02 HZ0 A 1 30.767 20.847 48.763 1.00 20.00 O HETATM 11 C03 HZ0 A 1 30.749 21.873 47.779 1.00 20.00 C HETATM 12 C04 HZ0 A 1 29.344 22.468 47.691 1.00 20.00 C HETATM 13 C05 HZ0 A 1 29.100 23.754 48.138 1.00 20.00 C HETATM 14 C06 HZ0 A 1 28.087 24.673 47.427 1.00 20.00 C HETATM 15 C07 HZ0 A 1 28.444 25.969 47.129 1.00 20.00 C HETATM 16 C08 HZ0 A 1 29.590 26.194 46.139 1.00 20.00 C HETATM 17 C09 HZ0 A 1 27.439 27.118 47.374 1.00 20.00 C HETATM 18 C11 HZ0 A 1 26.770 28.698 45.451 1.00 20.00 C HETATM 19 C12 HZ0 A 1 26.112 28.985 44.241 1.00 20.00 C HETATM 20 O13 HZ0 A 1 26.219 30.293 43.695 1.00 20.00 O HETATM 21 C14 HZ0 A 1 27.544 30.667 43.354 1.00 20.00 C HETATM 22 CL1 HZ0 A 1 24.536 28.307 42.096 1.00 20.00 CL HETATM 23 C18 HZ0 A 1 25.958 26.462 45.378 1.00 20.00 C HETATM 24 N19 HZ0 A 1 24.508 25.568 43.561 1.00 20.00 N HETATM 25 O22 HZ0 A 1 24.573 23.490 42.469 1.00 20.00 O HETATM 26 C23 HZ0 A 1 26.726 24.413 43.019 1.00 20.00 C HETATM 27 O25 HZ0 A 1 27.287 22.347 44.087 1.00 20.00 O HETATM 28 O27 HZ0 A 1 25.763 20.862 43.279 1.00 20.00 O HETATM 29 C29 HZ0 A 1 23.862 21.600 45.403 1.00 20.00 C HETATM 30 N30 HZ0 A 1 25.867 20.363 46.319 1.00 20.00 N HETATM 31 C31 HZ0 A 1 27.270 20.081 46.187 1.00 20.00 C HETATM 32 C32 HZ0 A 1 25.133 19.456 47.209 1.00 20.00 C HETATM 33 O33 HZ0 A 1 25.764 18.553 47.738 1.00 20.00 O HETATM 34 C34 HZ0 A 1 23.623 19.542 47.527 1.00 20.00 C HETATM 35 C35 HZ0 A 1 23.404 20.229 48.892 1.00 20.00 C HETATM 36 S36 HZ0 A 1 24.531 19.637 50.144 1.00 20.00 S HETATM 37 S37 HZ0 A 1 23.740 17.991 51.095 1.00 20.00 S HETATM 38 C38 HZ0 A 1 24.753 17.566 52.488 1.00 20.00 C HETATM 39 C39 HZ0 A 1 28.568 23.172 42.111 1.00 20.00 C HETATM 40 C40 HZ0 A 1 27.765 24.005 41.068 1.00 20.00 C HETATM 41 O41 HZ0 A 1 29.162 22.501 40.908 1.00 20.00 O HETATM 42 C42 HZ0 A 1 28.983 21.747 42.130 1.00 20.00 C HETATM 43 C43 HZ0 A 1 30.401 21.281 42.600 1.00 20.00 C HETATM 44 C44 HZ0 A 1 30.925 20.289 41.576 1.00 20.00 C HETATM 45 C45 HZ0 A 1 30.513 20.626 43.978 1.00 20.00 C HETATM 46 C46 HZ0 A 1 30.483 21.731 45.097 1.00 20.00 C HETATM 47 C47 HZ0 A 1 31.185 21.301 46.437 1.00 20.00 C HETATM 48 O48 HZ0 A 1 30.135 20.380 46.627 1.00 20.00 O HETATM 49 N49 HZ0 A 1 32.053 20.170 46.428 1.00 20.00 N HETATM 50 C50 HZ0 A 1 32.258 19.476 45.229 1.00 20.00 C HETATM 51 O51 HZ0 A 1 32.925 18.446 45.235 1.00 20.00 O HETATM 52 O52 HZ0 A 1 31.719 19.951 44.055 1.00 20.00 O HETATM 53 H1 HZ0 A 1 22.700 26.505 44.020 1.00 20.00 H HETATM 54 H2 HZ0 A 1 22.709 25.541 42.505 1.00 20.00 H HETATM 55 H3 HZ0 A 1 22.683 24.711 44.098 1.00 20.00 H HETATM 56 H4 HZ0 A 1 26.552 22.447 42.180 1.00 20.00 H HETATM 57 H5 HZ0 A 1 25.674 22.409 46.124 1.00 20.00 H HETATM 58 H6 HZ0 A 1 31.838 19.974 50.318 1.00 20.00 H HETATM 59 H7 HZ0 A 1 32.826 20.643 48.975 1.00 20.00 H HETATM 60 H8 HZ0 A 1 32.032 21.751 50.145 1.00 20.00 H HETATM 61 H9 HZ0 A 1 31.449 22.674 48.061 1.00 20.00 H HETATM 62 H10 HZ0 A 1 28.537 21.881 47.278 1.00 20.00 H HETATM 63 H12 HZ0 A 1 29.631 24.122 49.004 1.00 20.00 H HETATM 64 H14 HZ0 A 1 27.106 24.304 47.165 1.00 20.00 H HETATM 65 H083 HZ0 A 1 30.209 25.286 46.081 1.00 20.00 H HETATM 66 H081 HZ0 A 1 29.177 26.420 45.145 1.00 20.00 H HETATM 67 H082 HZ0 A 1 30.208 27.038 46.480 1.00 20.00 H HETATM 68 H091 HZ0 A 1 27.977 28.011 47.725 1.00 20.00 H HETATM 69 H17 HZ0 A 1 26.704 26.811 48.133 1.00 20.00 H HETATM 70 H18 HZ0 A 1 27.338 29.477 45.937 1.00 20.00 H HETATM 71 H142 HZ0 A 1 27.543 31.686 42.941 1.00 20.00 H HETATM 72 H141 HZ0 A 1 28.176 30.637 44.254 1.00 20.00 H HETATM 73 H19 HZ0 A 1 27.941 29.967 42.603 1.00 20.00 H HETATM 74 H20 HZ0 A 1 25.901 25.483 45.829 1.00 20.00 H HETATM 75 H21 HZ0 A 1 27.064 24.812 43.987 1.00 20.00 H HETATM 76 H22 HZ0 A 1 27.119 25.041 42.206 1.00 20.00 H HETATM 77 H23 HZ0 A 1 23.376 21.562 46.389 1.00 20.00 H HETATM 78 H24 HZ0 A 1 23.609 22.548 44.906 1.00 20.00 H HETATM 79 H25 HZ0 A 1 23.510 20.758 44.789 1.00 20.00 H HETATM 80 H313 HZ0 A 1 27.526 19.199 46.792 1.00 20.00 H HETATM 81 H311 HZ0 A 1 27.506 19.882 45.131 1.00 20.00 H HETATM 82 H312 HZ0 A 1 27.852 20.947 46.536 1.00 20.00 H HETATM 83 H26 HZ0 A 1 23.119 20.125 46.742 1.00 20.00 H HETATM 84 H27 HZ0 A 1 23.200 18.527 47.559 1.00 20.00 H HETATM 85 H28 HZ0 A 1 23.550 21.312 48.769 1.00 20.00 H HETATM 86 H29 HZ0 A 1 22.374 20.034 49.224 1.00 20.00 H HETATM 87 H30 HZ0 A 1 24.330 16.687 52.995 1.00 20.00 H HETATM 88 H31 HZ0 A 1 25.772 17.335 52.143 1.00 20.00 H HETATM 89 H32 HZ0 A 1 24.786 18.413 53.189 1.00 20.00 H HETATM 90 H33 HZ0 A 1 27.113 24.719 41.592 1.00 20.00 H HETATM 91 H34 HZ0 A 1 28.465 24.554 40.420 1.00 20.00 H HETATM 92 H35 HZ0 A 1 27.150 23.330 40.454 1.00 20.00 H HETATM 93 H36 HZ0 A 1 28.189 20.986 42.163 1.00 20.00 H HETATM 94 H431 HZ0 A 1 31.059 22.162 42.589 1.00 20.00 H HETATM 95 H442 HZ0 A 1 31.924 19.942 41.879 1.00 20.00 H HETATM 96 H441 HZ0 A 1 30.241 19.430 41.515 1.00 20.00 H HETATM 97 H443 HZ0 A 1 30.990 20.777 40.592 1.00 20.00 H HETATM 98 H37 HZ0 A 1 29.661 19.946 44.128 1.00 20.00 H HETATM 99 H461 HZ0 A 1 30.991 22.627 44.712 1.00 20.00 H HETATM 100 H38 HZ0 A 1 29.433 21.971 45.318 1.00 20.00 H HETATM 101 H39 HZ0 A 1 30.273 19.905 47.438 1.00 20.00 H HETATM 102 H40 HZ0 A 1 32.510 19.876 47.268 1.00 20.00 H CONECT 1 23 23 18 17 CONECT 2 22 3 3 19 CONECT 3 24 23 CONECT 4 24 53 54 55 CONECT 5 25 25 26 24 CONECT 6 39 26 27 56 CONECT 7 28 28 27 8 CONECT 8 29 30 57 CONECT 9 10 58 59 60 CONECT 10 11 CONECT 11 47 12 61 CONECT 12 13 13 62 CONECT 13 14 63 CONECT 14 15 15 64 CONECT 15 16 17 CONECT 16 65 66 67 CONECT 17 68 69 CONECT 18 19 19 70 CONECT 19 20 CONECT 20 21 CONECT 21 71 72 73 CONECT 23 74 CONECT 26 75 76 CONECT 29 77 78 79 CONECT 30 31 32 CONECT 31 80 81 82 CONECT 32 34 33 33 CONECT 34 35 83 84 CONECT 35 36 85 86 CONECT 36 37 CONECT 37 38 CONECT 38 87 88 89 CONECT 39 41 40 42 CONECT 40 90 91 92 CONECT 41 42 CONECT 42 43 93 CONECT 43 44 45 94 CONECT 44 95 96 97 CONECT 45 52 46 98 CONECT 46 47 99 100 CONECT 47 49 48 CONECT 48 101 CONECT 49 50 102 CONECT 50 52 51 51 END