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{
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{
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{
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"structure_string": "Li1 Pm1 Au2\n1.0\n0.000000 3.512276 3.512276\n3.512276 0.000000 3.512276\n3.512276 3.512276 0.000000\nLi Pm Au\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Pm\n0.750000 0.750000 0.750000 Au\n0.250000 0.250000 0.250000 Au\n",
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{
"id": "mp-29589",
"created_at": "2022-09-04T14:39:40.929845Z",
"structure_string": "Ta6 Se16 Br12\n1.0\n7.730344 0.000000 0.000000\n1.455725 11.455978 0.000000\n2.327578 3.887348 12.227640\nTa Se Br\n6 16 12\ndirect\n0.399353 0.500256 0.245524 Ta\n0.600647 0.499744 0.754476 Ta\n0.997600 0.002314 0.123621 Ta\n0.002400 0.997686 0.876379 Ta\n0.998583 0.001552 0.374887 Ta\n0.001417 0.998448 0.625113 Ta\n0.786493 0.887495 0.311534 Se\n0.213507 0.112505 0.688466 Se\n0.240390 0.896066 0.245993 Se\n0.759610 0.103934 0.754007 Se\n0.212122 0.116206 0.203106 Se\n0.787878 0.883794 0.796894 Se\n0.998098 0.804740 0.058057 Se\n0.001902 0.195260 0.941943 Se\n0.741582 0.942465 0.042823 Se\n0.258418 0.057535 0.957177 Se\n0.273416 0.953721 0.482704 Se\n0.726584 0.046279 0.517296 Se\n0.060177 0.806347 0.546617 Se\n0.251463 0.894188 0.760709 Se\n0.939823 0.193653 0.453383 Se\n0.748537 0.105812 0.239291 Se\n0.808487 0.577056 0.844983 Br\n0.191513 0.422944 0.155017 Br\n0.332520 0.597430 0.845731 Br\n0.639061 0.695625 0.594661 Br\n0.596770 0.577214 0.337770 Br\n0.403230 0.422786 0.662230 Br\n0.135274 0.606221 0.337692 Br\n0.864726 0.393779 0.662308 Br\n0.419913 0.691925 0.079924 Br\n0.580087 0.308075 0.920076 Br\n0.360939 0.304375 0.405339 Br\n0.667480 0.402570 0.154269 Br\n",
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{
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{
"id": "mp-1204090",
"created_at": "2022-09-04T14:39:08.309230Z",
"structure_string": "P12 H34 S12 N14 O14\n1.0\n11.621424 0.000000 0.000000\n3.439594 11.136294 0.000000\n5.522898 4.272220 9.418149\nP H S N O\n12 34 12 14 14\ndirect\n0.120664 0.784709 0.168404 P\n0.879336 0.215291 0.831596 P\n0.858988 0.773765 0.188243 P\n0.141012 0.226235 0.811757 P\n0.097846 0.779722 0.929367 P\n0.902154 0.220278 0.070633 P\n0.111113 0.054906 0.707158 P\n0.888887 0.945094 0.292842 P\n0.851040 0.941149 0.901986 P\n0.148960 0.058851 0.098014 P\n0.278667 0.956413 0.872105 P\n0.721333 0.043587 0.127895 P\n0.349479 0.767230 0.045221 H\n0.650521 0.232770 0.954779 H\n0.958760 0.755851 0.848704 H\n0.041240 0.244149 0.151296 H\n0.234136 0.243294 0.575131 H\n0.765864 0.756706 0.424869 H\n0.336453 0.317430 0.351770 H\n0.663547 0.682570 0.648230 H\n0.360852 0.394612 0.417255 H\n0.639148 0.605388 0.582745 H\n0.282041 0.446786 0.164385 H\n0.717959 0.553214 0.835615 H\n0.312894 0.305181 0.172779 H\n0.687106 0.694819 0.827221 H\n0.466572 0.623261 0.166290 H\n0.533428 0.376739 0.833710 H\n0.512468 0.631315 0.010437 H\n0.487532 0.368685 0.989563 H\n0.440324 0.581630 0.388347 H\n0.559676 0.418370 0.611653 H\n0.533139 0.460263 0.365490 H\n0.466861 0.539737 0.634510 H\n0.020797 0.694946 0.686142 H\n0.979203 0.305054 0.313858 H\n0.969086 0.576464 0.835826 H\n0.030914 0.423536 0.164174 H\n0.462017 0.747670 0.429613 H\n0.537983 0.252330 0.570387 H\n0.315711 0.712644 0.499675 H\n0.684289 0.287356 0.500325 H\n0.141695 0.733367 0.450898 H\n0.858305 0.266633 0.549102 H\n0.133261 0.852748 0.482644 H\n0.866739 0.147252 0.517356 H\n0.786119 0.616682 0.249578 S\n0.213881 0.383318 0.750422 S\n0.135746 0.629632 0.330837 S\n0.864254 0.370368 0.669163 S\n0.206659 0.626307 0.907411 S\n0.793341 0.373693 0.092589 S\n0.155351 0.041546 0.534368 S\n0.844649 0.958454 0.465632 S\n0.715028 0.957510 0.846202 S\n0.284972 0.042490 0.153798 S\n0.452295 0.981693 0.730322 S\n0.547705 0.018307 0.269678 S\n0.167719 0.927127 0.830845 N\n0.832281 0.072873 0.169155 N\n0.260876 0.828757 0.028745 N\n0.739124 0.171243 0.971255 N\n0.026696 0.774664 0.097350 N\n0.973304 0.225336 0.902650 N\n0.967311 0.817374 0.889631 N\n0.032689 0.182626 0.110369 N\n0.164168 0.184437 0.685392 N\n0.835832 0.815563 0.314608 N\n0.194203 0.082450 0.925810 N\n0.805797 0.917550 0.074190 N\n0.054004 0.927307 0.192496 N\n0.945996 0.072693 0.807504 N\n0.333187 0.310038 0.441124 O\n0.666813 0.689962 0.558876 O\n0.347370 0.370757 0.174706 O\n0.652630 0.629243 0.825294 O\n0.466103 0.680822 0.069934 O\n0.533897 0.319178 0.930066 O\n0.462273 0.523311 0.339286 O\n0.537727 0.476689 0.660714 O\n0.949626 0.670237 0.783160 O\n0.050374 0.329763 0.216840 O\n0.407811 0.673993 0.481192 O\n0.592189 0.326007 0.518808 O\n0.148004 0.756670 0.518531 O\n0.851996 0.243330 0.481469 O\n",
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{
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"structure_string": "Ba1 Ca1 Ce1 Sn1 O6\n1.0\n0.000000 -4.284501 -4.284501\n4.284501 0.000000 -4.284501\n4.284501 -4.284501 0.000000\nBa Ca Ce Sn O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 Sn\n0.741820 0.258180 0.258180 O\n0.258180 0.741820 0.741820 O\n0.741820 0.258180 0.741820 O\n0.258180 0.741820 0.258180 O\n0.741820 0.741820 0.258180 O\n0.258180 0.258180 0.741820 O\n",
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{
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},
{
"id": "mp-1193601",
"created_at": "2022-09-04T14:39:05.688352Z",
"structure_string": "Ba2 Br4 O22\n1.0\n3.535533 -6.123722 0.000000\n3.535533 6.123722 0.000000\n0.000000 0.000000 11.986108\nBa Br O\n2 4 22\ndirect\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.531862 Br\n0.333333 0.666667 0.031862 Br\n0.333333 0.666667 0.468138 Br\n0.666667 0.333333 0.968138 Br\n0.666667 0.333333 0.395719 O\n0.333333 0.666667 0.895719 O\n0.333333 0.666667 0.604281 O\n0.666667 0.333333 0.104281 O\n0.736787 0.577838 0.582360 O\n0.422162 0.158948 0.582360 O\n0.841052 0.263213 0.582360 O\n0.263213 0.422162 0.082360 O\n0.577838 0.841052 0.082360 O\n0.158948 0.736787 0.082360 O\n0.263213 0.422162 0.417640 O\n0.577838 0.841052 0.417640 O\n0.158948 0.736787 0.417640 O\n0.736787 0.577838 0.917640 O\n0.422162 0.158948 0.917640 O\n0.841052 0.263213 0.917640 O\n0.049816 0.914019 0.750000 O\n0.085981 0.135797 0.750000 O\n0.864203 0.950184 0.750000 O\n0.950184 0.085981 0.250000 O\n0.914019 0.864203 0.250000 O\n0.135797 0.049816 0.250000 O\n",
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"formula_full": "Ba2 Br4 O22",
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"updated_at": "2021-11-28T01:34:25.012000Z",
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},
{
"id": "mp-752611",
"created_at": "2022-09-04T14:39:28.800237Z",
"structure_string": "Li1 Nb1 Te2 W1 O12\n1.0\n5.178316 0.000000 0.000000\n-0.001654 5.405235 0.000000\n-0.005664 -0.401463 7.481133\nLi Nb Te W O\n1 1 2 1 12\ndirect\n0.500698 0.930936 0.282951 Li\n0.505753 0.503219 0.506411 Nb\n0.004034 0.007341 0.495333 Te\n0.496310 0.505240 0.998649 Te\n0.995075 0.006649 0.991337 W\n0.303514 0.812799 0.056433 O\n0.698042 0.821236 0.539823 O\n0.202127 0.715519 0.440231 O\n0.796329 0.708878 0.943404 O\n0.601566 0.518442 0.241214 O\n0.388862 0.507222 0.754758 O\n0.200943 0.299711 0.050375 O\n0.816736 0.310096 0.548991 O\n0.307776 0.191269 0.433874 O\n0.698366 0.207700 0.946072 O\n0.880904 0.011400 0.245014 O\n0.101606 0.003481 0.747699 O\n",
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{
"id": "mp-765999",
"created_at": "2022-09-04T14:39:18.904046Z",
"structure_string": "Li4 V4 C4 O16\n1.0\n3.185226 0.000038 0.020572\n0.185616 0.004049 9.427815\n-0.000120 -9.363829 -0.004106\nLi V C O\n4 4 4 16\ndirect\n0.252630 0.408624 0.808063 Li\n0.252796 0.908391 0.691924 Li\n0.747194 0.091595 0.308061 Li\n0.747366 0.591350 0.191961 Li\n0.239848 0.881311 0.061576 V\n0.760136 0.118670 0.938425 V\n0.240259 0.381026 0.438734 V\n0.759803 0.618969 0.561293 V\n0.255768 0.334011 0.130133 C\n0.256004 0.834011 0.369786 C\n0.743981 0.165999 0.630225 C\n0.744233 0.666015 0.869847 C\n0.251399 0.998454 0.887350 O\n0.251512 0.498831 0.612681 O\n0.748541 0.501161 0.387319 O\n0.748616 0.001527 0.112656 O\n0.240066 0.260651 0.248804 O\n0.240934 0.760457 0.251176 O\n0.759092 0.239547 0.748830 O\n0.759942 0.739389 0.751188 O\n0.265327 0.260062 0.007087 O\n0.265339 0.760286 0.492855 O\n0.734671 0.239712 0.507146 O\n0.734695 0.739938 0.992913 O\n0.256900 0.466824 0.127684 O\n0.256854 0.966831 0.372129 O\n0.743063 0.033171 0.627884 O\n0.743047 0.533195 0.872272 O\n",
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}
]
}