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{
"id": "mp-1211217",
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"structure_string": "Li12 Al26 Cu16\n1.0\n0.000000 0.000000 4.957837\n12.714178 0.000000 0.000000\n0.000000 12.714178 0.000000\nLi Al Cu\n12 26 16\ndirect\n0.000000 0.583144 0.083144 Li\n0.000000 0.416856 0.916856 Li\n0.000000 0.916856 0.583144 Li\n0.000000 0.083144 0.416856 Li\n0.500000 0.216479 0.716479 Li\n0.500000 0.783521 0.283521 Li\n0.500000 0.283521 0.216479 Li\n0.500000 0.716479 0.783521 Li\n0.500000 0.641726 0.141726 Li\n0.500000 0.358274 0.858274 Li\n0.500000 0.858274 0.641726 Li\n0.500000 0.141726 0.358274 Li\n0.500000 0.094355 0.116917 Al\n0.500000 0.905645 0.883083 Al\n0.500000 0.883083 0.094355 Al\n0.500000 0.405645 0.616917 Al\n0.500000 0.116917 0.905645 Al\n0.500000 0.594355 0.383083 Al\n0.500000 0.616917 0.594355 Al\n0.500000 0.383083 0.405645 Al\n0.000000 0.150162 0.193167 Al\n0.000000 0.849838 0.806833 Al\n0.000000 0.806833 0.150162 Al\n0.000000 0.349838 0.693167 Al\n0.000000 0.193167 0.849838 Al\n0.000000 0.650162 0.306833 Al\n0.000000 0.693167 0.650162 Al\n0.000000 0.306833 0.349838 Al\n0.500000 0.073544 0.573544 Al\n0.500000 0.926456 0.426456 Al\n0.500000 0.426456 0.073544 Al\n0.500000 0.573544 0.926456 Al\n0.000000 0.137247 0.637247 Al\n0.000000 0.862753 0.362753 Al\n0.000000 0.362753 0.137247 Al\n0.000000 0.637247 0.862753 Al\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Al\n0.250879 0.242747 0.022503 Cu\n0.749121 0.757253 0.977497 Cu\n0.250879 0.757253 0.977497 Cu\n0.250879 0.977497 0.242747 Cu\n0.749121 0.257253 0.522503 Cu\n0.749121 0.242747 0.022503 Cu\n0.749121 0.022503 0.757253 Cu\n0.250879 0.742747 0.477497 Cu\n0.250879 0.022503 0.757253 Cu\n0.749121 0.742747 0.477497 Cu\n0.749121 0.977497 0.242747 Cu\n0.250879 0.257253 0.522503 Cu\n0.749121 0.522503 0.742747 Cu\n0.250879 0.477497 0.257253 Cu\n0.749121 0.477497 0.257253 Cu\n0.250879 0.522503 0.742747 Cu\n",
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"spacegroup": 127
},
{
"id": "mp-1233582",
"created_at": "2022-09-04T14:46:15.765383Z",
"structure_string": "Cs6 Mg1 Np2 H16 O18\n1.0\n-0.169285 0.000000 8.095126\n-6.521781 6.069171 0.302760\n-6.521781 -6.069171 0.302760\nCs Mg Np H O\n6 1 2 16 18\ndirect\n0.503711 0.601743 0.804083 Cs\n0.996289 0.195917 0.398257 Cs\n0.462387 0.377269 0.203459 Cs\n0.037613 0.796541 0.622731 Cs\n0.250000 0.967749 0.032251 Cs\n0.750000 0.073075 0.926925 Cs\n0.750000 0.730153 0.269847 Mg\n0.997107 0.488835 0.004881 Np\n0.502893 0.995119 0.511165 Np\n0.934318 0.437180 0.699814 H\n0.565682 0.300186 0.562820 H\n0.020092 0.565255 0.314616 H\n0.479908 0.685384 0.434745 H\n0.203985 0.083316 0.714065 H\n0.296015 0.285935 0.916684 H\n0.746496 0.020937 0.287843 H\n0.753504 0.712157 0.979063 H\n0.090146 0.235299 0.745069 H\n0.409854 0.254931 0.764701 H\n0.018229 0.848427 0.249890 H\n0.481771 0.750110 0.151573 H\n0.169693 0.473589 0.599616 H\n0.330308 0.400384 0.526411 H\n0.819035 0.476578 0.438568 H\n0.680965 0.561432 0.523422 H\n0.870071 0.710394 0.939753 O\n0.629929 0.060247 0.289606 O\n0.123703 0.299191 0.066029 O\n0.376296 0.933971 0.700809 O\n0.191611 0.598113 0.005153 O\n0.308389 0.994847 0.401887 O\n0.792704 0.397163 0.005800 O\n0.707296 0.994200 0.602837 O\n0.041410 0.435124 0.747048 O\n0.458590 0.252952 0.564876 O\n0.915201 0.545989 0.271595 O\n0.584799 0.728405 0.454011 O\n0.089760 0.123490 0.738185 O\n0.410240 0.261815 0.876509 O\n0.911012 0.883912 0.289489 O\n0.588988 0.710511 0.116087 O\n0.250000 0.490341 0.509659 O\n0.750000 0.464957 0.535043 O\n",
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"formula_full": "Cs6 Mg1 Np2 H16 O18",
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},
{
"id": "mp-772429",
"created_at": "2022-09-04T14:46:15.780969Z",
"structure_string": "Li8 V4 B20 O40\n1.0\n15.402505 0.000000 0.000000\n0.000000 7.262050 0.000000\n0.000000 0.112059 7.289604\nLi V B O\n8 4 20 40\ndirect\n0.831321 0.901185 0.999908 Li\n0.668679 0.901185 0.499908 Li\n0.074005 0.694854 0.590522 Li\n0.425995 0.694854 0.090522 Li\n0.574005 0.305146 0.909478 Li\n0.925995 0.305146 0.409478 Li\n0.331321 0.098815 0.500092 Li\n0.168679 0.098815 0.000092 Li\n0.875905 0.847971 0.535574 V\n0.624095 0.847971 0.035574 V\n0.375905 0.152029 0.964426 V\n0.124095 0.152029 0.464426 V\n0.974001 0.797922 0.908735 B\n0.525999 0.797922 0.408735 B\n0.223372 0.783436 0.521325 B\n0.276628 0.783436 0.021325 B\n0.495757 0.752771 0.733381 B\n0.004243 0.752771 0.233381 B\n0.379552 0.681991 0.505314 B\n0.120448 0.681991 0.005314 B\n0.741906 0.542395 0.501082 B\n0.758094 0.542395 0.001082 B\n0.241906 0.457605 0.998918 B\n0.258094 0.457605 0.498918 B\n0.879552 0.318009 0.994686 B\n0.620448 0.318009 0.494686 B\n0.995757 0.247229 0.766619 B\n0.504243 0.247229 0.266619 B\n0.723372 0.216564 0.978675 B\n0.776628 0.216564 0.478675 B\n0.474001 0.202078 0.591265 B\n0.025999 0.202078 0.091265 B\n0.157623 0.906910 0.538800 O\n0.342377 0.906910 0.038800 O\n0.911339 0.849683 0.787278 O\n0.588661 0.849683 0.287278 O\n0.190978 0.829505 0.993761 O\n0.548545 0.829051 0.593944 O\n0.309022 0.829505 0.493761 O\n0.951455 0.829051 0.093944 O\n0.523707 0.750203 0.912301 O\n0.976293 0.750203 0.412301 O\n0.767224 0.722743 0.509460 O\n0.052741 0.723534 0.862258 O\n0.732776 0.722743 0.009460 O\n0.447259 0.723534 0.362258 O\n0.416997 0.682076 0.690186 O\n0.083003 0.682076 0.190186 O\n0.197376 0.597093 0.537275 O\n0.302624 0.597093 0.037275 O\n0.657372 0.497961 0.530689 O\n0.157372 0.502039 0.969311 O\n0.842628 0.497961 0.030689 O\n0.342628 0.502039 0.469311 O\n0.697376 0.402907 0.962725 O\n0.802624 0.402907 0.462725 O\n0.916997 0.317924 0.809814 O\n0.583003 0.317924 0.309814 O\n0.552741 0.276466 0.637742 O\n0.267224 0.277257 0.990540 O\n0.947259 0.276466 0.137742 O\n0.232776 0.277257 0.490540 O\n0.023707 0.249797 0.587699 O\n0.476293 0.249797 0.087699 O\n0.048545 0.170949 0.906056 O\n0.690978 0.170495 0.506239 O\n0.451455 0.170949 0.406056 O\n0.809022 0.170495 0.006239 O\n0.411339 0.150317 0.712722 O\n0.088661 0.150317 0.212722 O\n0.657623 0.093090 0.961200 O\n0.842377 0.093090 0.461200 O\n",
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"elements": [
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],
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"formula_full": "Li8 V4 B20 O40",
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"spacegroup": 14
},
{
"id": "mp-780796",
"created_at": "2022-09-04T14:46:15.784711Z",
"structure_string": "Li4 Mn4 P4 H24 O30\n1.0\n-0.000439 4.838280 0.003075\n-11.273886 2.419624 -0.528487\n-1.208882 0.007944 12.064153\nLi Mn P H O\n4 4 4 24 30\ndirect\n0.988994 0.788869 0.921720 Li\n0.224258 0.789038 0.422042 Li\n0.776150 0.210966 0.577236 Li\n0.012931 0.210511 0.078610 Li\n0.077367 0.501908 0.875446 Mn\n0.579171 0.498414 0.623757 Mn\n0.420020 0.501575 0.375759 Mn\n0.922270 0.497769 0.124150 Mn\n0.519878 0.670220 0.785508 P\n0.810322 0.669408 0.286189 P\n0.189138 0.330479 0.713207 P\n0.479796 0.329664 0.214217 P\n0.567188 0.963672 0.856118 H\n0.235153 0.930871 0.767576 H\n0.468035 0.963934 0.352996 H\n0.151827 0.827900 0.626184 H\n0.833998 0.925476 0.268237 H\n0.019181 0.832722 0.124266 H\n0.898252 0.772411 0.596575 H\n0.328388 0.773403 0.097967 H\n0.631060 0.463875 0.929906 H\n0.094957 0.536349 0.570196 H\n0.904029 0.463848 0.429107 H\n0.368326 0.536153 0.070104 H\n0.680999 0.226376 0.900732 H\n0.102840 0.227859 0.403011 H\n0.989715 0.163987 0.876791 H\n0.167875 0.074139 0.730811 H\n0.851193 0.171376 0.373311 H\n0.534341 0.035648 0.646447 H\n0.759955 0.014994 0.933757 H\n0.767168 0.068771 0.231804 H\n0.778555 0.983703 0.568500 H\n0.434700 0.035527 0.144074 H\n0.224817 0.016103 0.431314 H\n0.241128 0.984284 0.066724 H\n0.725260 0.939254 0.909546 O\n0.334513 0.940215 0.407203 O\n0.010527 0.829322 0.567946 O\n0.296615 0.778064 0.810137 O\n0.162813 0.830099 0.067076 O\n0.604956 0.664563 0.660568 O\n0.927209 0.776868 0.311641 O\n0.793116 0.657647 0.858150 O\n0.731311 0.664270 0.161168 O\n0.549027 0.657296 0.358547 O\n0.405545 0.550921 0.805890 O\n0.253174 0.562019 0.532381 O\n0.043247 0.550057 0.306135 O\n0.814747 0.438289 0.967218 O\n0.184857 0.561385 0.032507 O\n0.956124 0.449812 0.693106 O\n0.746205 0.438134 0.466992 O\n0.594149 0.448960 0.193858 O\n0.450751 0.342781 0.640782 O\n0.268007 0.335765 0.838105 O\n0.207023 0.342011 0.141581 O\n0.073284 0.222952 0.687521 O\n0.394701 0.335289 0.339101 O\n0.842920 0.168601 0.933040 O\n0.703967 0.221756 0.189583 O\n0.991577 0.170817 0.431606 O\n0.667644 0.059400 0.592141 O\n0.313339 0.002401 0.751930 O\n0.275550 0.059874 0.090906 O\n0.688707 0.997432 0.247740 O\n",
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"formula_full": "Li4 Mn4 P4 H24 O30",
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{
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"structure_string": "K2 As2 O8\n1.0\n-3.709981 3.709981 3.682336\n3.709981 -3.709981 3.682336\n3.709981 3.709981 -3.682336\nK As O\n2 2 8\ndirect\n0.750000 0.250000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.250000 0.750000 0.500000 As\n0.000000 0.000000 0.000000 As\n0.496546 0.049429 0.757356 O\n0.957927 0.700571 0.947117 O\n0.292073 0.739190 0.242644 O\n0.753454 0.010810 0.052883 O\n0.260810 0.503454 0.552883 O\n0.299429 0.246546 0.257356 O\n0.950571 0.707927 0.447117 O\n0.989190 0.042073 0.742644 O\n",
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"formula_full": "K2 As2 O8",
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{
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"structure_string": "Na1 Sr1 Sn1 Bi1 O6\n1.0\n0.000000 -4.159039 -4.159039\n4.159039 0.000000 -4.159039\n4.159039 -4.159039 0.000000\nNa Sr Sn Bi O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Sr\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Bi\n0.747098 0.252902 0.252902 O\n0.252902 0.747098 0.747098 O\n0.747098 0.252902 0.747098 O\n0.252902 0.747098 0.252902 O\n0.747098 0.747098 0.252902 O\n0.252902 0.252902 0.747098 O\n",
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{
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"structure_string": "Li6 Nb2 V4 O12\n1.0\n0.008288 -3.110482 5.108434\n-3.635612 -4.252235 -2.619298\n6.128648 -1.261142 -2.519029\nLi Nb V O\n6 2 4 12\ndirect\n0.835233 0.835049 0.333481 Li\n0.331805 0.832879 0.333611 Li\n0.997479 0.507725 0.995896 Li\n0.500931 0.518465 0.989458 Li\n0.169214 0.158700 0.671060 Li\n0.665575 0.147480 0.677258 Li\n0.806381 0.333231 0.331949 Nb\n0.360062 0.333607 0.334614 Nb\n0.997334 0.990966 0.996449 V\n0.665581 0.666742 0.661359 V\n0.501127 0.999528 0.005168 V\n0.169798 0.675531 0.670428 V\n0.756231 0.246499 0.011044 O\n0.244154 0.240341 0.013825 O\n0.922821 0.426731 0.652660 O\n0.410839 0.419634 0.655422 O\n0.922436 0.913954 0.680419 O\n0.411429 0.905484 0.676066 O\n0.243564 0.752999 0.986429 O\n0.754831 0.760447 0.990207 O\n0.088745 0.573720 0.347767 O\n0.581533 0.598802 0.325353 O\n0.077831 0.093185 0.318917 O\n0.585066 0.068305 0.341158 O\n",
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