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{
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{
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{
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"structure_string": "Rb2 Y1 Au1 I6\n1.0\n0.000000 6.053428 6.053428\n6.053428 0.000000 6.053428\n6.053428 6.053428 0.000000\nRb Y Au I\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Au\n0.749584 0.250416 0.250416 I\n0.250416 0.250416 0.749584 I\n0.250416 0.749584 0.749584 I\n0.250416 0.749584 0.250416 I\n0.749584 0.250416 0.749584 I\n0.749584 0.749584 0.250416 I\n",
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"formula_full": "Rb2 Y1 Au1 I6",
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{
"id": "mp-1201985",
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"structure_string": "Rb4 Y4 B16 H64\n1.0\n12.661874 0.000000 0.000000\n0.000000 8.442647 0.000000\n0.000000 8.356527 10.807181\nRb Y B H\n4 4 16 64\ndirect\n0.959865 0.419202 0.831390 Rb\n0.459865 0.580798 0.668610 Rb\n0.040135 0.580798 0.168610 Rb\n0.540135 0.419202 0.331390 Rb\n0.679443 0.916419 0.833727 Y\n0.179443 0.083581 0.666273 Y\n0.320557 0.083581 0.166273 Y\n0.820557 0.916419 0.333727 Y\n0.839321 0.964979 0.917801 B\n0.339321 0.035021 0.582199 B\n0.160679 0.035021 0.082199 B\n0.660679 0.964979 0.417801 B\n0.618756 0.248493 0.647653 B\n0.118756 0.751507 0.852347 B\n0.381244 0.751507 0.352347 B\n0.881244 0.248493 0.147652 B\n0.724631 0.698695 0.774282 B\n0.224631 0.301305 0.725718 B\n0.275369 0.301305 0.225718 B\n0.775369 0.698695 0.274282 B\n0.538453 0.759291 0.991592 B\n0.038453 0.240709 0.508408 B\n0.461547 0.240709 0.008408 B\n0.961547 0.759291 0.491592 B\n0.917093 0.987093 0.959184 H\n0.417093 0.012907 0.540816 H\n0.082907 0.012907 0.040816 H\n0.582907 0.987093 0.459184 H\n0.799916 0.797618 0.994151 H\n0.299916 0.202382 0.505849 H\n0.200084 0.202382 0.005849 H\n0.700084 0.797618 0.494151 H\n0.770442 0.089628 0.890986 H\n0.270442 0.910372 0.609014 H\n0.229558 0.910372 0.109014 H\n0.729558 0.089628 0.390986 H\n0.859850 0.981410 0.823313 H\n0.359850 0.018590 0.676687 H\n0.140150 0.018590 0.176687 H\n0.640150 0.981410 0.323313 H\n0.588888 0.409121 0.557817 H\n0.088888 0.590879 0.942183 H\n0.411112 0.590879 0.442183 H\n0.911112 0.409121 0.057817 H\n0.546838 0.123033 0.693995 H\n0.046838 0.876967 0.806005 H\n0.453162 0.876967 0.306005 H\n0.953162 0.123033 0.193995 H\n0.692157 0.183546 0.621659 H\n0.192157 0.816454 0.878341 H\n0.307843 0.816454 0.378341 H\n0.807843 0.183546 0.121659 H\n0.651710 0.260577 0.728195 H\n0.151710 0.739423 0.771805 H\n0.348290 0.739423 0.271805 H\n0.848290 0.260577 0.228195 H\n0.745731 0.592922 0.745772 H\n0.245731 0.407078 0.754228 H\n0.254269 0.407078 0.254228 H\n0.754269 0.592922 0.245772 H\n0.776758 0.855634 0.713830 H\n0.276758 0.144366 0.786170 H\n0.223242 0.144366 0.286170 H\n0.723242 0.855634 0.213830 H\n0.740452 0.613798 0.885747 H\n0.240452 0.386202 0.614253 H\n0.259548 0.386202 0.114253 H\n0.759548 0.613798 0.385747 H\n0.630071 0.747822 0.754685 H\n0.130071 0.252178 0.745315 H\n0.369929 0.252178 0.245315 H\n0.869929 0.747822 0.254685 H\n0.469075 0.684948 0.067020 H\n0.969075 0.315052 0.432980 H\n0.530925 0.315052 0.932980 H\n0.030925 0.684948 0.567020 H\n0.575190 0.911552 0.973794 H\n0.075190 0.088448 0.526206 H\n0.424810 0.088448 0.026206 H\n0.924810 0.911552 0.473794 H\n0.613781 0.643187 0.021256 H\n0.113781 0.356813 0.478744 H\n0.386219 0.356813 0.978744 H\n0.886219 0.643187 0.521256 H\n0.505662 0.810760 0.890359 H\n0.005662 0.189240 0.609641 H\n0.494338 0.189240 0.109641 H\n0.994338 0.810760 0.390359 H\n",
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"elements": [
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"density": 1.3438840477296854,
"density_atomic": 0.07617169650936552,
"volume": 1155.2847584165354,
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"formula_full": "Rb4 Y4 B16 H64",
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"spacegroup": 14
},
{
"id": "mp-556206",
"created_at": "2022-09-04T14:46:35.836633Z",
"structure_string": "Rb12 Y8 B12 O36\n1.0\n8.812029 0.000000 0.000000\n0.000000 9.689682 0.000000\n0.000000 0.000000 12.377726\nRb Y B O\n12 8 12 36\ndirect\n0.352868 0.358406 0.742649 Rb\n0.203939 0.032849 0.577640 Rb\n0.796061 0.967151 0.077640 Rb\n0.093117 0.694652 0.592690 Rb\n0.147132 0.858406 0.242649 Rb\n0.852868 0.141594 0.742649 Rb\n0.296061 0.532849 0.077640 Rb\n0.906883 0.305348 0.092690 Rb\n0.703939 0.467151 0.577640 Rb\n0.647132 0.641594 0.242649 Rb\n0.593117 0.805348 0.592690 Rb\n0.406883 0.194652 0.092690 Rb\n0.010175 0.508645 0.330083 Y\n0.643185 0.613628 0.898306 Y\n0.989825 0.491355 0.830083 Y\n0.489825 0.008645 0.830083 Y\n0.356815 0.386372 0.398306 Y\n0.856815 0.113628 0.398306 Y\n0.143185 0.886372 0.898306 Y\n0.510175 0.991355 0.330083 Y\n0.136765 0.175336 0.906612 B\n0.363235 0.675336 0.406612 B\n0.169324 0.196073 0.288769 B\n0.863235 0.824664 0.406612 B\n0.330676 0.696073 0.788769 B\n0.669324 0.303927 0.288769 B\n0.035331 0.348121 0.564026 B\n0.464669 0.848121 0.064026 B\n0.964669 0.651879 0.064026 B\n0.830676 0.803927 0.788769 B\n0.535331 0.151879 0.564026 B\n0.636765 0.324664 0.906612 B\n0.476210 0.904841 0.166793 O\n0.539541 0.378860 0.274571 O\n0.380853 0.918446 0.985679 O\n0.880853 0.581554 0.985679 O\n0.303864 0.140831 0.332521 O\n0.251477 0.610754 0.341999 O\n0.961506 0.227012 0.537695 O\n0.617136 0.182233 0.907778 O\n0.619147 0.081554 0.485679 O\n0.803864 0.359169 0.332521 O\n0.976210 0.595159 0.166793 O\n0.954141 0.912095 0.466831 O\n0.674234 0.162756 0.261589 O\n0.882864 0.682233 0.407778 O\n0.461506 0.272988 0.537695 O\n0.454141 0.587905 0.466831 O\n0.325766 0.837244 0.761589 O\n0.545859 0.412095 0.966831 O\n0.174234 0.337244 0.261589 O\n0.248523 0.110754 0.841999 O\n0.045859 0.087905 0.966831 O\n0.523790 0.095159 0.666793 O\n0.039541 0.121140 0.274571 O\n0.119147 0.418446 0.485679 O\n0.382864 0.817767 0.407778 O\n0.696136 0.859169 0.832521 O\n0.825766 0.662756 0.761589 O\n0.196136 0.640831 0.832521 O\n0.751477 0.889246 0.341999 O\n0.960459 0.878860 0.774571 O\n0.038494 0.772988 0.037695 O\n0.023790 0.404841 0.666793 O\n0.117136 0.317767 0.907778 O\n0.748523 0.389246 0.841999 O\n0.460459 0.621140 0.774571 O\n0.538494 0.727012 0.037695 O\n",
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{
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"structure_string": "Rb2 Y2 Be2 F12\n1.0\n5.912975 0.000000 0.000000\n0.000000 6.565102 0.000000\n0.000000 2.914806 6.648349\nRb Y Be F\n2 2 2 12\ndirect\n0.250000 0.078502 0.787714 Rb\n0.750000 0.921498 0.212286 Rb\n0.250000 0.391450 0.180365 Y\n0.750000 0.608550 0.819635 Y\n0.250000 0.767307 0.464396 Be\n0.750000 0.232693 0.535604 Be\n0.464012 0.758561 0.595134 F\n0.535988 0.241439 0.404866 F\n0.964012 0.241439 0.404866 F\n0.035988 0.758561 0.595134 F\n0.250000 0.569455 0.398884 F\n0.750000 0.430545 0.601116 F\n0.499012 0.675592 0.031014 F\n0.500988 0.324408 0.968986 F\n0.999012 0.324408 0.968986 F\n0.000988 0.675592 0.031014 F\n0.250000 0.993710 0.272339 F\n0.750000 0.006290 0.727661 F\n",
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{
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{
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"structure_string": "Rb2 Y1 Cu1 Br6\n1.0\n0.000000 5.500772 5.500772\n5.500772 0.000000 5.500772\n5.500772 5.500772 0.000000\nRb Y Cu Br\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Cu\n0.245190 0.245190 0.754810 Br\n0.245190 0.754810 0.754810 Br\n0.754810 0.754810 0.245190 Br\n0.245190 0.754810 0.245190 Br\n0.754810 0.245190 0.754810 Br\n0.754810 0.245190 0.245190 Br\n",
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{
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{
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{
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{
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]
}