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cluster0.4.pdb
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CRYST1 31.452 31.452 31.452 90.00 90.00 90.00 P 1 1
ATOM 1 O MOL M 0 3.236 1.703 -2.808 0.00 0.00 MOL
ATOM 2 C MOL M 0 2.437 1.082 -2.152 0.00 0.00 MOL
ATOM 3 N MOL M 0 1.366 0.546 -2.637 0.00 0.00 MOL
ATOM 4 C1 MOL M 0 0.982 0.436 -4.083 0.00 0.00 MOL
ATOM 5 C2 MOL M 0 -0.495 0.463 -4.487 0.00 0.00 MOL
ATOM 6 N1 MOL M 0 -1.426 0.044 -3.587 0.00 0.00 MOL
ATOM 7 C3 MOL M 0 -2.926 0.175 -3.756 0.00 0.00 MOL
ATOM 8 C4 MOL M 0 -3.753 0.452 -2.498 0.00 0.00 MOL
ATOM 9 N2 MOL M 0 -3.209 -0.054 -1.366 0.00 0.00 MOL
ATOM 10 C5 MOL M 0 -3.640 0.198 0.041 0.00 0.00 MOL
ATOM 11 C6 MOL M 0 -2.651 0.140 1.221 0.00 0.00 MOL
ATOM 12 N3 MOL M 0 -2.003 -1.003 1.400 0.00 0.00 MOL
ATOM 13 C7 MOL M 0 -0.672 -0.992 1.819 0.00 0.00 MOL
ATOM 14 H MOL M 0 -0.278 -0.004 1.567 0.00 0.00 MOL
ATOM 15 C8 MOL M 0 0.019 -2.193 1.214 0.00 0.00 MOL
ATOM 16 C9 MOL M 0 -0.314 -0.854 3.384 0.00 0.00 MOL
ATOM 17 N4 MOL M 0 -1.387 -1.051 4.183 0.00 0.00 MOL
ATOM 18 C10 MOL M 0 -1.459 -0.665 5.653 0.00 0.00 MOL
ATOM 19 H1 MOL M 0 -2.521 -0.617 5.904 0.00 0.00 MOL
ATOM 20 C11 MOL M 0 -0.791 -1.870 6.370 0.00 0.00 MOL
ATOM 21 C12 MOL M 0 -1.857 -2.933 6.745 0.00 0.00 MOL
ATOM 22 N5 MOL M 0 -1.635 -3.761 7.672 0.00 0.00 MOL
ATOM 23 O1 MOL M 0 -2.908 -3.079 6.160 0.00 0.00 MOL
ATOM 24 C13 MOL M 0 -0.789 0.715 6.073 0.00 0.00 MOL
ATOM 25 N6 MOL M 0 -1.398 1.915 5.587 0.00 0.00 MOL
ATOM 26 C14 MOL M 0 -0.711 3.248 5.508 0.00 0.00 MOL
ATOM 27 H2 MOL M 0 -0.192 3.371 6.461 0.00 0.00 MOL
ATOM 28 C15 MOL M 0 -1.779 4.373 5.406 0.00 0.00 MOL
ATOM 29 C16 MOL M 0 -3.059 3.563 4.985 0.00 0.00 MOL
ATOM 30 H3 MOL M 0 -3.916 3.959 5.535 0.00 0.00 MOL
ATOM 31 O2 MOL M 0 -3.219 3.547 3.605 0.00 0.00 MOL
ATOM 32 C17 MOL M 0 -2.855 2.069 5.367 0.00 0.00 MOL
ATOM 33 O3 MOL M 0 0.290 0.832 6.641 0.00 0.00 MOL
ATOM 34 O4 MOL M 0 0.838 -0.489 3.727 0.00 0.00 MOL
ATOM 35 O5 MOL M 0 -2.520 1.045 2.007 0.00 0.00 MOL
ATOM 36 O6 MOL M 0 -4.728 1.154 -2.386 0.00 0.00 MOL
ATOM 37 H4 MOL M 0 -2.933 1.040 -4.425 0.00 0.00 MOL
ATOM 38 C18 MOL M 0 -3.643 -0.954 -4.557 0.00 0.00 MOL
ATOM 39 H5 MOL M 0 -3.121 -1.089 -5.507 0.00 0.00 MOL
ATOM 40 C19 MOL M 0 -3.430 -2.249 -3.732 0.00 0.00 MOL
ATOM 41 C20 MOL M 0 -5.133 -0.638 -4.894 0.00 0.00 MOL
ATOM 42 C21 MOL M 0 -5.562 -1.656 -5.979 0.00 0.00 MOL
ATOM 43 O7 MOL M 0 -0.899 1.046 -5.442 0.00 0.00 MOL
ATOM 44 C22 MOL M 0 2.483 1.005 -0.659 0.00 0.00 MOL
ATOM 45 H6 MOL M 0 3.364 1.640 -0.541 0.00 0.00 MOL
ATOM 46 C23 MOL M 0 2.715 -0.411 -0.037 0.00 0.00 MOL
ATOM 47 C24 MOL M 0 2.617 -1.543 -1.024 0.00 0.00 MOL
ATOM 48 C25 MOL M 0 1.508 -2.379 -1.225 0.00 0.00 MOL
ATOM 49 S MOL M 0 -0.216 -2.207 -0.551 0.00 0.00 MOL
ATOM 50 O8 MOL M 0 -0.600 -0.863 -1.067 0.00 0.00 MOL
ATOM 51 N7 MOL M 0 1.922 -3.556 -1.876 0.00 0.00 MOL
ATOM 52 C26 MOL M 0 3.241 -3.430 -2.121 0.00 0.00 MOL
ATOM 53 C27 MOL M 0 3.615 -2.243 -1.698 0.00 0.00 MOL
ATOM 54 C28 MOL M 0 4.849 -1.777 -2.013 0.00 0.00 MOL
ATOM 55 C29 MOL M 0 5.622 -2.590 -2.865 0.00 0.00 MOL
ATOM 56 C30 MOL M 0 5.230 -3.792 -3.317 0.00 0.00 MOL
ATOM 57 O9 MOL M 0 5.954 -4.608 -4.136 0.00 0.00 MOL
ATOM 58 C31 MOL M 0 3.966 -4.199 -2.955 0.00 0.00 MOL
ATOM 59 N8 MOL M 0 1.441 1.755 0.111 0.00 0.00 MOL
ATOM 60 C32 MOL M 0 1.495 2.248 1.362 0.00 0.00 MOL
ATOM 61 C33 MOL M 0 0.249 3.032 1.784 0.00 0.00 MOL
ATOM 62 C34 MOL M 0 0.019 4.397 1.182 0.00 0.00 MOL
ATOM 63 H7 MOL M 0 -0.776 4.926 1.711 0.00 0.00 MOL
ATOM 64 C35 MOL M 0 1.329 5.305 1.392 0.00 0.00 MOL
ATOM 65 C36 MOL M 0 -0.301 4.306 -0.360 0.00 0.00 MOL
ATOM 66 H8 MOL M 0 0.602 4.106 -0.943 0.00 0.00 MOL
ATOM 67 O10 MOL M 0 -1.227 3.245 -0.610 0.00 0.00 MOL
ATOM 68 C37 MOL M 0 -0.526 5.600 -0.977 0.00 0.00 MOL
ATOM 69 O11 MOL M 0 0.756 6.179 -1.501 0.00 0.00 MOL
ATOM 70 H9 MOL M 0 -0.459 2.334 1.330 0.00 0.00 MOL
ATOM 71 N9 MOL M 0 -0.262 2.930 3.199 0.00 0.00 MOL
ATOM 72 C38 MOL M 0 0.309 3.382 4.360 0.00 0.00 MOL
ATOM 73 O12 MOL M 0 1.492 3.672 4.468 0.00 0.00 MOL
ATOM 74 O13 MOL M 0 2.536 2.254 1.981 0.00 0.00 MOL
ATOM 75 H10 MOL M 0 0.945 -0.113 -2.000 0.00 0.00 MOL
ATOM 76 H11 MOL M 0 1.414 1.198 -4.737 0.00 0.00 MOL
ATOM 77 H12 MOL M 0 1.263 -0.525 -4.524 0.00 0.00 MOL
ATOM 78 H13 MOL M 0 -0.981 -0.248 -2.730 0.00 0.00 MOL
ATOM 79 H14 MOL M 0 -2.367 -0.609 -1.389 0.00 0.00 MOL
ATOM 80 H15 MOL M 0 -4.441 -0.521 0.236 0.00 0.00 MOL
ATOM 81 H16 MOL M 0 -3.948 1.246 0.057 0.00 0.00 MOL
ATOM 82 H17 MOL M 0 -2.240 -1.767 0.785 0.00 0.00 MOL
ATOM 83 H18 MOL M 0 1.079 -2.086 1.460 0.00 0.00 MOL
ATOM 84 H19 MOL M 0 -0.426 -3.047 1.729 0.00 0.00 MOL
ATOM 85 H20 MOL M 0 -2.296 -1.155 3.757 0.00 0.00 MOL
ATOM 86 H21 MOL M 0 0.090 -2.200 5.816 0.00 0.00 MOL
ATOM 87 H22 MOL M 0 -0.408 -1.579 7.350 0.00 0.00 MOL
ATOM 88 H23 MOL M 0 -2.298 -4.476 7.932 0.00 0.00 MOL
ATOM 89 H24 MOL M 0 -0.735 -3.645 8.112 0.00 0.00 MOL
ATOM 90 H25 MOL M 0 -1.439 5.188 4.763 0.00 0.00 MOL
ATOM 91 H26 MOL M 0 -2.164 4.748 6.357 0.00 0.00 MOL
ATOM 92 H27 MOL M 0 -4.050 3.209 3.225 0.00 0.00 MOL
ATOM 93 H28 MOL M 0 -3.240 1.276 4.721 0.00 0.00 MOL
ATOM 94 H29 MOL M 0 -3.282 1.945 6.366 0.00 0.00 MOL
ATOM 95 H30 MOL M 0 -3.908 -3.032 -4.325 0.00 0.00 MOL
ATOM 96 H31 MOL M 0 -2.380 -2.512 -3.588 0.00 0.00 MOL
ATOM 97 H32 MOL M 0 -3.978 -2.196 -2.790 0.00 0.00 MOL
ATOM 98 H33 MOL M 0 -5.695 -0.896 -3.994 0.00 0.00 MOL
ATOM 99 H34 MOL M 0 -5.309 0.391 -5.214 0.00 0.00 MOL
ATOM 100 H35 MOL M 0 -5.252 -2.682 -5.766 0.00 0.00 MOL
ATOM 101 H36 MOL M 0 -6.649 -1.700 -6.073 0.00 0.00 MOL
ATOM 102 H37 MOL M 0 -5.036 -1.264 -6.852 0.00 0.00 MOL
ATOM 103 H38 MOL M 0 2.078 -0.420 0.850 0.00 0.00 MOL
ATOM 104 H39 MOL M 0 3.706 -0.272 0.400 0.00 0.00 MOL
ATOM 105 H40 MOL M 0 1.299 -4.334 -2.047 0.00 0.00 MOL
ATOM 106 H41 MOL M 0 5.255 -0.770 -1.957 0.00 0.00 MOL
ATOM 107 H42 MOL M 0 6.552 -2.144 -3.211 0.00 0.00 MOL
ATOM 108 H43 MOL M 0 6.905 -4.397 -4.125 0.00 0.00 MOL
ATOM 109 H44 MOL M 0 3.524 -5.127 -3.309 0.00 0.00 MOL
ATOM 110 H45 MOL M 0 0.537 1.792 -0.336 0.00 0.00 MOL
ATOM 111 H46 MOL M 0 2.158 4.849 0.847 0.00 0.00 MOL
ATOM 112 H47 MOL M 0 1.130 6.306 1.003 0.00 0.00 MOL
ATOM 113 H48 MOL M 0 1.570 5.323 2.457 0.00 0.00 MOL
ATOM 114 H49 MOL M 0 -1.709 3.334 -1.452 0.00 0.00 MOL
ATOM 115 H50 MOL M 0 -1.119 5.414 -1.876 0.00 0.00 MOL
ATOM 116 H51 MOL M 0 -1.009 6.279 -0.270 0.00 0.00 MOL
ATOM 117 H52 MOL M 0 0.658 7.135 -1.656 0.00 0.00 MOL
ATOM 118 H53 MOL M 0 -1.170 2.505 3.315 0.00 0.00 MOL
END