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{
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{
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{
"id": "mp-559437",
"created_at": "2022-09-04T14:39:21.934688Z",
"structure_string": "Zn2 C4 O8\n1.0\n5.311731 0.000000 0.000000\n0.000000 5.384379 0.000000\n0.000000 3.122305 5.498950\nZn C O\n2 4 8\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.112379 0.454362 0.090018 C\n0.612379 0.545638 0.409982 C\n0.387621 0.454362 0.590018 C\n0.887621 0.545638 0.909982 C\n0.300856 0.638956 0.639250 O\n0.800856 0.361044 0.860750 O\n0.804584 0.798784 0.824175 O\n0.699144 0.361044 0.360750 O\n0.695416 0.798784 0.324175 O\n0.304584 0.201216 0.675825 O\n0.199144 0.638956 0.139250 O\n0.195416 0.201216 0.175825 O\n",
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{
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"structure_string": "Cs2 Sm4 Cu2 Se8\n1.0\n2.116679 -7.436494 0.000000\n2.116679 7.436494 0.000000\n0.000000 0.000000 14.679895\nCs Sm Cu Se\n2 4 2 8\ndirect\n0.893195 0.106805 0.750000 Cs\n0.106805 0.893195 0.250000 Cs\n0.365906 0.634094 0.061992 Sm\n0.634094 0.365906 0.938008 Sm\n0.365906 0.634094 0.438008 Sm\n0.634094 0.365906 0.561992 Sm\n0.165777 0.834223 0.750000 Cu\n0.834223 0.165777 0.250000 Cu\n0.421940 0.578060 0.250000 Se\n0.578060 0.421940 0.750000 Se\n0.741403 0.258597 0.108906 Se\n0.258597 0.741403 0.891094 Se\n0.000000 0.000000 0.500000 Se\n0.000000 0.000000 0.000000 Se\n0.741403 0.258597 0.391094 Se\n0.258597 0.741403 0.608906 Se\n",
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{
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"structure_string": "Se8 N8\n1.0\n5.154283 5.140336 0.000000\n-5.154283 5.140336 0.000000\n0.000000 1.636793 6.597248\nSe N\n8 8\ndirect\n0.762817 0.361925 0.428454 Se\n0.234610 0.024122 0.588481 Se\n0.361925 0.762817 0.928454 Se\n0.765390 0.975878 0.411519 Se\n0.237183 0.638075 0.571546 Se\n0.024122 0.234610 0.088481 Se\n0.638075 0.237183 0.071546 Se\n0.975878 0.765390 0.911519 Se\n0.396564 0.603436 0.750000 N\n0.009857 0.607988 0.729959 N\n0.992123 0.007876 0.250000 N\n0.007876 0.992124 0.750000 N\n0.603436 0.396564 0.250000 N\n0.392012 0.990143 0.770041 N\n0.607988 0.009857 0.229959 N\n0.990143 0.392012 0.270041 N\n",
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{
"id": "mp-1196286",
"created_at": "2022-09-04T14:39:21.948513Z",
"structure_string": "Rb12 Ni8 N28 O84\n1.0\n7.356391 0.000000 0.000000\n0.000000 9.162423 0.000000\n0.000000 0.000000 28.607882\nRb Ni N O\n12 8 28 84\ndirect\n0.914154 0.981891 0.250000 Rb\n0.585846 0.481891 0.250000 Rb\n0.085846 0.018109 0.750000 Rb\n0.414154 0.518109 0.750000 Rb\n0.877672 0.997833 0.436078 Rb\n0.622328 0.497833 0.063922 Rb\n0.122328 0.002167 0.936078 Rb\n0.377672 0.502167 0.563922 Rb\n0.122328 0.002167 0.563922 Rb\n0.377672 0.502167 0.936078 Rb\n0.877672 0.997833 0.063922 Rb\n0.622328 0.497833 0.436078 Rb\n0.098685 0.369767 0.359513 Ni\n0.401315 0.869767 0.140487 Ni\n0.901315 0.630233 0.859513 Ni\n0.598685 0.130233 0.640487 Ni\n0.901315 0.630233 0.640487 Ni\n0.598685 0.130233 0.859513 Ni\n0.098685 0.369767 0.140487 Ni\n0.401315 0.869767 0.359513 Ni\n0.372331 0.878037 0.250000 N\n0.127669 0.378037 0.250000 N\n0.627669 0.121963 0.750000 N\n0.872331 0.621963 0.750000 N\n0.107234 0.340202 0.464443 N\n0.392766 0.840202 0.035557 N\n0.892766 0.659798 0.964443 N\n0.607234 0.159798 0.535557 N\n0.892766 0.659798 0.535557 N\n0.607234 0.159798 0.964443 N\n0.107234 0.340202 0.035557 N\n0.392766 0.840202 0.464443 N\n0.083287 0.683890 0.382038 N\n0.416713 0.183890 0.117962 N\n0.916713 0.316110 0.882038 N\n0.583287 0.816110 0.617962 N\n0.916713 0.316110 0.617962 N\n0.583287 0.816110 0.882038 N\n0.083287 0.683890 0.117962 N\n0.416713 0.183890 0.382038 N\n0.690121 0.756177 0.327788 N\n0.809879 0.256177 0.172212 N\n0.309879 0.243823 0.827788 N\n0.190121 0.743823 0.672212 N\n0.309879 0.243823 0.672212 N\n0.190121 0.743823 0.827788 N\n0.690121 0.756177 0.172212 N\n0.809879 0.256177 0.327788 N\n0.013602 0.314813 0.426207 O\n0.486398 0.814813 0.073793 O\n0.986398 0.685187 0.926207 O\n0.513602 0.185187 0.573793 O\n0.986398 0.685187 0.573793 O\n0.513602 0.185187 0.926207 O\n0.013602 0.314813 0.073793 O\n0.486398 0.814813 0.426207 O\n0.964199 0.343269 0.250000 O\n0.535801 0.843269 0.250000 O\n0.035801 0.656731 0.750000 O\n0.464199 0.156731 0.750000 O\n0.908354 0.749587 0.502944 O\n0.591646 0.249587 0.997056 O\n0.091646 0.250413 0.002944 O\n0.408354 0.750413 0.497056 O\n0.091646 0.250413 0.497056 O\n0.408354 0.750413 0.002944 O\n0.908354 0.749587 0.997056 O\n0.591646 0.249587 0.502944 O\n0.822423 0.707732 0.306233 O\n0.677577 0.207732 0.193767 O\n0.177577 0.292268 0.806233 O\n0.322423 0.792268 0.693767 O\n0.177577 0.292268 0.693767 O\n0.322423 0.792268 0.806233 O\n0.822423 0.707732 0.193767 O\n0.677577 0.207732 0.306233 O\n0.204962 0.451752 0.467142 O\n0.295038 0.951752 0.032858 O\n0.795038 0.548248 0.967142 O\n0.704962 0.048248 0.532858 O\n0.795038 0.548248 0.532858 O\n0.704962 0.048248 0.967142 O\n0.204962 0.451752 0.032858 O\n0.295038 0.951752 0.467142 O\n0.818633 0.390004 0.341386 O\n0.681367 0.890004 0.158614 O\n0.181367 0.609996 0.841386 O\n0.318633 0.109996 0.658614 O\n0.181367 0.609996 0.658614 O\n0.318633 0.109996 0.841386 O\n0.818633 0.390004 0.158614 O\n0.681367 0.890004 0.341386 O\n0.935505 0.658036 0.400975 O\n0.564495 0.158036 0.099025 O\n0.064495 0.341964 0.900975 O\n0.435505 0.841964 0.599025 O\n0.064495 0.341964 0.599025 O\n0.435505 0.841964 0.900975 O\n0.935505 0.658036 0.099025 O\n0.564495 0.158036 0.400975 O\n0.951349 0.178071 0.336763 O\n0.548651 0.678071 0.163237 O\n0.048651 0.821929 0.836763 O\n0.451349 0.321929 0.663237 O\n0.048651 0.821929 0.663237 O\n0.451349 0.321929 0.836763 O\n0.951349 0.178071 0.163237 O\n0.548651 0.678071 0.336763 O\n0.284746 0.896135 0.288284 O\n0.215254 0.396135 0.211716 O\n0.715254 0.103865 0.788284 O\n0.784746 0.603865 0.711716 O\n0.715254 0.103865 0.711716 O\n0.784746 0.603865 0.788284 O\n0.284746 0.896135 0.211716 O\n0.215254 0.396135 0.288284 O\n0.361123 0.316755 0.378757 O\n0.138877 0.816755 0.121243 O\n0.638877 0.683245 0.878757 O\n0.861123 0.183245 0.621243 O\n0.638877 0.683245 0.621243 O\n0.861123 0.183245 0.878757 O\n0.361123 0.316755 0.121243 O\n0.138877 0.816755 0.378757 O\n0.184883 0.583758 0.365215 O\n0.315117 0.083758 0.134785 O\n0.815117 0.416242 0.865215 O\n0.684883 0.916242 0.634785 O\n0.815117 0.416242 0.634785 O\n0.684883 0.916242 0.865215 O\n0.184883 0.583758 0.134785 O\n0.315117 0.083758 0.365215 O\n",
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{
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"structure_string": "K4 Ba8 Cd8 Sb12\n1.0\n5.033294 0.000000 0.000000\n0.000000 13.362707 0.000000\n0.000000 0.000000 17.034583\nK Ba Cd Sb\n4 8 8 12\ndirect\n0.250000 0.398863 0.445725 K\n0.250000 0.898863 0.054275 K\n0.750000 0.601137 0.554275 K\n0.750000 0.101137 0.945725 K\n0.250000 0.099655 0.572346 Ba\n0.250000 0.599655 0.927654 Ba\n0.750000 0.900345 0.427654 Ba\n0.750000 0.400345 0.072346 Ba\n0.250000 0.372846 0.710394 Ba\n0.250000 0.872846 0.789606 Ba\n0.750000 0.627154 0.289606 Ba\n0.750000 0.127154 0.210394 Ba\n0.250000 0.304176 0.916348 Cd\n0.250000 0.804176 0.583652 Cd\n0.750000 0.695824 0.083652 Cd\n0.750000 0.195824 0.416348 Cd\n0.250000 0.365191 0.216499 Cd\n0.250000 0.865191 0.283501 Cd\n0.750000 0.634809 0.783501 Cd\n0.750000 0.134809 0.716499 Cd\n0.250000 0.078113 0.365272 Sb\n0.250000 0.578113 0.134728 Sb\n0.750000 0.921887 0.634728 Sb\n0.750000 0.421887 0.865272 Sb\n0.250000 0.133658 0.803500 Sb\n0.250000 0.633658 0.696500 Sb\n0.750000 0.866342 0.196500 Sb\n0.750000 0.366342 0.303500 Sb\n0.250000 0.713077 0.424300 Sb\n0.250000 0.213077 0.075700 Sb\n0.750000 0.286923 0.575700 Sb\n0.750000 0.786923 0.924300 Sb\n",
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{
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{
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{
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"structure_string": "Mn8 P16 O40\n1.0\n7.792612 0.000000 0.000000\n0.000000 11.654022 0.000000\n0.000000 7.681604 13.360222\nMn P O\n8 16 40\ndirect\n0.610405 0.346707 0.682808 Mn\n0.889595 0.346707 0.182808 Mn\n0.389595 0.653293 0.317192 Mn\n0.110405 0.653293 0.817192 Mn\n0.764174 0.179412 0.954692 Mn\n0.735826 0.179412 0.454692 Mn\n0.235826 0.820588 0.045308 Mn\n0.264174 0.820588 0.545308 Mn\n0.953274 0.468525 0.732711 P\n0.546726 0.468525 0.232711 P\n0.046726 0.531475 0.267289 P\n0.453274 0.531475 0.767289 P\n0.732535 0.642990 0.456253 P\n0.767465 0.642990 0.956253 P\n0.267465 0.357010 0.543747 P\n0.232535 0.357010 0.043747 P\n0.677704 0.864206 0.135613 P\n0.822296 0.864206 0.635613 P\n0.322296 0.135794 0.864387 P\n0.177704 0.135794 0.364387 P\n0.663570 0.080388 0.277286 P\n0.836430 0.080388 0.777286 P\n0.336430 0.919612 0.722714 P\n0.163570 0.919612 0.222714 P\n0.967117 0.513070 0.810168 O\n0.532883 0.513070 0.310168 O\n0.032883 0.486930 0.189832 O\n0.467117 0.486930 0.689832 O\n0.797100 0.375000 0.761305 O\n0.702900 0.375000 0.261305 O\n0.202900 0.625000 0.238695 O\n0.297100 0.625000 0.738695 O\n0.717750 0.505147 0.545074 O\n0.782250 0.505147 0.045074 O\n0.282250 0.494853 0.454926 O\n0.217750 0.494853 0.954926 O\n0.587879 0.691507 0.378646 O\n0.912121 0.691507 0.878646 O\n0.412121 0.308493 0.621354 O\n0.087879 0.308493 0.121354 O\n0.664851 0.011141 0.057103 O\n0.835149 0.011141 0.557103 O\n0.335149 0.988859 0.942897 O\n0.164851 0.988859 0.442897 O\n0.501047 0.801771 0.166915 O\n0.998953 0.801771 0.666915 O\n0.498953 0.198229 0.833085 O\n0.001047 0.198229 0.333085 O\n0.667641 0.080080 0.375231 O\n0.832359 0.080080 0.875231 O\n0.332359 0.919920 0.624769 O\n0.167641 0.919920 0.124769 O\n0.754262 0.197451 0.188659 O\n0.745738 0.197451 0.688659 O\n0.245738 0.802549 0.811341 O\n0.254262 0.802549 0.311341 O\n0.631378 0.283034 0.960106 O\n0.868622 0.283034 0.460106 O\n0.368622 0.716966 0.039894 O\n0.131378 0.716966 0.539894 O\n0.967692 0.191895 0.973330 O\n0.532308 0.191895 0.473330 O\n0.032308 0.808105 0.026670 O\n0.467692 0.808105 0.526670 O\n",
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]
}