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{
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{
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{
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"structure_string": "Li8 Al6 Ge6 Br2 O24\n1.0\n8.771333 0.000000 0.000000\n0.000000 8.771333 0.000000\n0.000000 0.000000 8.771333\nLi Al Ge Br O\n8 6 6 2 24\ndirect\n0.819357 0.819357 0.180643 Li\n0.680643 0.680643 0.680643 Li\n0.819357 0.180643 0.819357 Li\n0.680643 0.319357 0.319357 Li\n0.180643 0.819357 0.819357 Li\n0.319357 0.680643 0.319357 Li\n0.319357 0.319357 0.680643 Li\n0.180643 0.180643 0.180643 Li\n0.000000 0.750000 0.500000 Al\n0.250000 0.500000 0.000000 Al\n0.500000 0.000000 0.750000 Al\n0.500000 0.000000 0.250000 Al\n0.000000 0.250000 0.500000 Al\n0.750000 0.500000 0.000000 Al\n0.000000 0.500000 0.250000 Ge\n0.500000 0.750000 0.000000 Ge\n0.500000 0.250000 0.000000 Ge\n0.000000 0.500000 0.750000 Ge\n0.750000 0.000000 0.500000 Ge\n0.250000 0.000000 0.500000 Ge\n0.000000 0.000000 0.000000 Br\n0.500000 0.500000 0.500000 Br\n0.638884 0.360871 0.095185 O\n0.904815 0.361116 0.360871 O\n0.639129 0.095185 0.361116 O\n0.595185 0.860871 0.138884 O\n0.861116 0.404815 0.860871 O\n0.095185 0.361116 0.639129 O\n0.138884 0.404815 0.139129 O\n0.404815 0.139129 0.138884 O\n0.138884 0.595185 0.860871 O\n0.860871 0.861116 0.404815 O\n0.095185 0.638884 0.360871 O\n0.861116 0.595185 0.139129 O\n0.360871 0.904815 0.361116 O\n0.360871 0.095185 0.638884 O\n0.638884 0.639129 0.904815 O\n0.595185 0.139129 0.861116 O\n0.639129 0.904815 0.638884 O\n0.139129 0.138884 0.404815 O\n0.361116 0.639129 0.095185 O\n0.139129 0.861116 0.595185 O\n0.404815 0.860871 0.861116 O\n0.860871 0.138884 0.595185 O\n0.361116 0.360871 0.904815 O\n0.904815 0.638884 0.639129 O\n",
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"formula_full": "Li8 Al6 Ge6 Br2 O24",
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{
"id": "mp-1205053",
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"structure_string": "Ca4 P12 N4 O36\n1.0\n10.285397 0.000000 0.000000\n0.000000 7.552742 0.000000\n0.000000 7.513138 12.612989\nCa P N O\n4 12 4 36\ndirect\n0.013307 0.524527 0.218586 Ca\n0.513307 0.475473 0.281414 Ca\n0.986693 0.475473 0.781414 Ca\n0.486693 0.524527 0.718586 Ca\n0.749944 0.903810 0.663455 P\n0.249944 0.096190 0.836545 P\n0.250056 0.096190 0.336545 P\n0.750056 0.903810 0.163455 P\n0.749572 0.327823 0.632398 P\n0.249572 0.672177 0.867602 P\n0.250428 0.672177 0.367602 P\n0.750428 0.327823 0.132398 P\n0.786851 0.261128 0.455190 P\n0.286851 0.738872 0.044810 P\n0.213149 0.738872 0.544810 P\n0.713149 0.261128 0.955190 P\n0.408868 0.141979 0.584345 N\n0.908868 0.858021 0.915655 N\n0.591132 0.858021 0.415655 N\n0.091132 0.141979 0.084345 N\n0.819902 0.026553 0.549341 O\n0.319902 0.973447 0.950659 O\n0.180098 0.973447 0.450659 O\n0.680098 0.026553 0.049341 O\n0.719132 0.082884 0.689286 O\n0.219132 0.917116 0.810714 O\n0.280868 0.917116 0.310714 O\n0.780868 0.082884 0.189286 O\n0.808192 0.383428 0.519126 O\n0.308192 0.616572 0.980874 O\n0.191808 0.616572 0.480874 O\n0.691808 0.383428 0.019126 O\n0.846142 0.754790 0.742481 O\n0.346142 0.245210 0.757519 O\n0.153858 0.245210 0.257519 O\n0.653858 0.754790 0.242481 O\n0.622866 0.811739 0.658013 O\n0.122866 0.188261 0.841987 O\n0.377134 0.188261 0.341987 O\n0.877134 0.811739 0.158013 O\n0.853719 0.361739 0.692808 O\n0.353719 0.638261 0.807192 O\n0.146281 0.638261 0.307192 O\n0.646281 0.361739 0.192808 O\n0.622457 0.434844 0.619741 O\n0.122457 0.565156 0.880259 O\n0.377543 0.565156 0.380259 O\n0.877543 0.434844 0.119741 O\n0.646243 0.274425 0.426462 O\n0.146243 0.725575 0.073538 O\n0.353757 0.725575 0.573538 O\n0.853757 0.274425 0.926462 O\n0.889362 0.327806 0.372592 O\n0.389362 0.672194 0.127408 O\n0.110638 0.672194 0.627408 O\n0.610638 0.327806 0.872592 O\n",
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{
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{
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{
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{
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},
{
"id": "mp-759812",
"created_at": "2022-09-04T14:43:24.622339Z",
"structure_string": "Li4 Ti11 O24\n1.0\n2.994744 9.817180 0.000000\n-2.994744 9.817180 0.000000\n0.000000 3.624586 7.688717\nLi Ti O\n4 11 24\ndirect\n0.584034 0.584034 0.531984 Li\n0.415966 0.415966 0.468016 Li\n0.089056 0.089056 0.789076 Li\n0.910944 0.910944 0.210924 Li\n0.666793 0.177567 0.838890 Ti\n0.822433 0.333207 0.161110 Ti\n0.170570 0.170570 0.314259 Ti\n0.341466 0.341466 0.157279 Ti\n0.177567 0.666793 0.838890 Ti\n0.333207 0.822433 0.161110 Ti\n0.000000 0.500000 0.500000 Ti\n0.829430 0.829430 0.685741 Ti\n0.658534 0.658534 0.842721 Ti\n0.000000 0.000000 0.500000 Ti\n0.500000 0.000000 0.500000 Ti\n0.865883 0.301592 0.404685 O\n0.698408 0.134117 0.595315 O\n0.653383 0.164848 0.071746 O\n0.177971 0.177971 0.564185 O\n0.155796 0.155796 0.113605 O\n0.489362 0.489362 0.748367 O\n0.346176 0.346176 0.923339 O\n0.327211 0.327211 0.412823 O\n0.510638 0.510638 0.251633 O\n0.034028 0.465514 0.270995 O\n0.164848 0.653383 0.071746 O\n0.835152 0.346617 0.928254 O\n0.301592 0.865883 0.404685 O\n0.134117 0.698408 0.595315 O\n0.965972 0.534486 0.729005 O\n0.007080 0.007080 0.255865 O\n0.672789 0.672789 0.587177 O\n0.992920 0.992920 0.744135 O\n0.844204 0.844204 0.886395 O\n0.822029 0.822029 0.435815 O\n0.653824 0.653824 0.076661 O\n0.534486 0.965972 0.729005 O\n0.346617 0.835152 0.928254 O\n0.465514 0.034028 0.270995 O\n",
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]
}