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{
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{
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"structure_string": "Ca10 Ta8 O30\n1.0\n2.768615 -4.795382 0.000000\n2.768615 4.795382 0.000000\n0.000000 0.000000 23.455478\nCa Ta O\n10 8 30\ndirect\n0.333333 0.666667 0.231004 Ca\n0.333333 0.666667 0.381260 Ca\n0.000000 0.000000 0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.333333 0.666667 0.731004 Ca\n0.333333 0.666667 0.881260 Ca\n0.666667 0.333333 0.118740 Ca\n0.666667 0.333333 0.268996 Ca\n0.666667 0.333333 0.618740 Ca\n0.666667 0.333333 0.768996 Ca\n0.333333 0.666667 0.052233 Ta\n0.000000 0.000000 0.156511 Ta\n0.000000 0.000000 0.343489 Ta\n0.000000 0.000000 0.656511 Ta\n0.000000 0.000000 0.843489 Ta\n0.333333 0.666667 0.552233 Ta\n0.666667 0.333333 0.447767 Ta\n0.666667 0.333333 0.947767 Ta\n0.077990 0.739987 0.806575 O\n0.099933 0.776533 0.095958 O\n0.223467 0.900067 0.595958 O\n0.000000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n0.260013 0.922010 0.306575 O\n0.077990 0.338003 0.306575 O\n0.099933 0.323400 0.595958 O\n0.223467 0.323400 0.095958 O\n0.260013 0.338003 0.806575 O\n0.338003 0.260013 0.693425 O\n0.661997 0.922010 0.806575 O\n0.323400 0.223467 0.404042 O\n0.323400 0.099933 0.904042 O\n0.500000 0.500000 0.000000 O\n0.500000 0.500000 0.500000 O\n0.676600 0.900067 0.095958 O\n0.676600 0.776533 0.595958 O\n0.338003 0.077990 0.193425 O\n0.661997 0.739987 0.306575 O\n0.739987 0.661997 0.193425 O\n0.776533 0.676600 0.904042 O\n0.500000 0.000000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.900067 0.676600 0.404042 O\n0.922010 0.661997 0.693425 O\n0.739987 0.077990 0.693425 O\n0.776533 0.099933 0.404042 O\n0.900067 0.223467 0.904042 O\n0.922010 0.260013 0.193425 O\n",
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"formula_full": "Ca10 Ta8 O30",
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{
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"created_at": "2022-09-04T14:44:52.270744Z",
"structure_string": "Rb4 Be4 Cd2 O12 F16\n1.0\n-6.254910 0.000000 1.804314\n0.427379 0.000000 -8.521648\n0.000000 -11.681138 0.000000\nRb Be Cd O F\n4 4 2 12 16\ndirect\n0.860094 0.583506 0.138679 Rb\n0.139906 0.416494 0.861321 Rb\n0.139906 0.916494 0.638679 Rb\n0.860094 0.083506 0.361321 Rb\n0.754976 0.593521 0.834164 Be\n0.245024 0.406479 0.165836 Be\n0.245024 0.906479 0.334164 Be\n0.754976 0.093521 0.665836 Be\n0.500000 0.000000 0.000000 Cd\n0.500000 0.500000 0.500000 Cd\n0.268957 0.876546 0.871642 O\n0.731043 0.123454 0.128358 O\n0.731043 0.623454 0.371642 O\n0.268957 0.376546 0.628358 O\n0.427174 0.657066 0.635209 O\n0.572826 0.342934 0.364791 O\n0.572826 0.842934 0.135209 O\n0.427174 0.157066 0.864791 O\n0.856334 0.966592 0.951255 O\n0.143666 0.033408 0.048745 O\n0.143666 0.533408 0.451255 O\n0.856334 0.466592 0.548745 O\n0.547179 0.636585 0.803296 F\n0.452821 0.363415 0.196704 F\n0.452821 0.863415 0.303296 F\n0.547179 0.136585 0.696704 F\n0.708748 0.940425 0.588388 F\n0.291252 0.059575 0.411612 F\n0.291252 0.559575 0.088388 F\n0.708748 0.440425 0.911612 F\n0.903623 0.738289 0.921041 F\n0.096377 0.261711 0.078959 F\n0.096377 0.761711 0.421041 F\n0.903623 0.238289 0.578959 F\n0.899790 0.593152 0.729819 F\n0.100210 0.406848 0.270181 F\n0.100210 0.906848 0.229819 F\n0.899790 0.093152 0.770181 F\n",
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{
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"structure_string": "Ba6 Sr2 Sb4 O18\n1.0\n6.172911 0.000000 0.000000\n-3.035738 5.383340 0.000000\n-0.506795 -0.637048 15.353123\nBa Sr Sb O\n6 2 4 18\ndirect\n0.319002 0.647405 0.406792 Ba\n0.680998 0.352595 0.593208 Ba\n0.655962 0.330841 0.902794 Ba\n0.979582 0.002027 0.250447 Ba\n0.020418 0.997973 0.749553 Ba\n0.344038 0.669159 0.097206 Ba\n0.000000 0.000000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.300865 0.639579 0.843928 Sb\n0.636788 0.305158 0.343246 Sb\n0.363212 0.694842 0.656754 Sb\n0.699135 0.360421 0.156072 Sb\n0.223922 0.419719 0.568682 O\n0.894054 0.226288 0.102403 O\n0.259506 0.907186 0.595801 O\n0.776078 0.580281 0.431318 O\n0.569410 0.755242 0.934476 O\n0.464175 0.508194 0.752977 O\n0.901147 0.693387 0.111327 O\n0.430590 0.244758 0.065524 O\n0.098853 0.306613 0.888673 O\n0.699137 0.853059 0.612947 O\n0.105946 0.773712 0.897597 O\n0.050923 0.536064 0.729184 O\n0.535825 0.491806 0.247023 O\n0.949077 0.463936 0.270816 O\n0.740494 0.092814 0.404199 O\n0.300863 0.146941 0.387053 O\n0.516487 0.053231 0.231724 O\n0.483513 0.946769 0.768276 O\n",
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{
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{
"id": "mp-686028",
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"structure_string": "Sr12 Nb4 O22\n1.0\n5.179958 -0.005943 3.021952\n1.669166 4.907380 3.060235\n-0.126158 0.238189 24.214373\nSr Nb O\n12 4 22\ndirect\n0.159100 0.332118 0.069741 Sr\n0.461450 0.574291 0.116757 Sr\n0.227181 0.262884 0.296707 Sr\n0.404383 0.500024 0.377106 Sr\n0.642665 0.804615 0.198221 Sr\n0.213363 0.221168 0.574819 Sr\n0.484426 0.512919 0.616406 Sr\n0.227531 0.276213 0.799333 Sr\n0.653155 0.777853 0.424712 Sr\n0.443063 0.499983 0.883331 Sr\n0.645792 0.757781 0.703698 Sr\n0.698112 0.774280 0.922633 Sr\n0.986447 0.054785 0.996935 Nb\n0.934729 0.032720 0.248226 Nb\n0.928794 0.002801 0.500256 Nb\n0.947677 0.035480 0.748696 Nb\n0.211189 0.246330 0.184599 O\n0.225507 0.727767 0.212899 O\n0.769652 0.375956 0.027589 O\n0.802222 0.808914 0.078730 O\n0.789103 0.189454 0.171476 O\n0.662354 0.339806 0.283028 O\n0.194085 0.153044 0.414062 O\n0.065171 0.875742 0.328778 O\n0.661770 0.823794 0.307733 O\n0.633024 0.304152 0.459707 O\n0.676059 0.098863 0.581620 O\n0.210759 0.789059 0.692797 O\n0.226256 0.846539 0.538195 O\n0.312355 0.066148 0.995940 O\n0.911709 0.683248 0.504207 O\n0.812425 0.327841 0.669672 O\n0.229873 0.221035 0.706938 O\n0.643030 0.284600 0.803179 O\n0.239450 0.738762 0.963247 O\n0.107090 0.809895 0.825377 O\n0.679606 0.829639 0.795568 O\n0.874944 0.270992 0.917304 O\n",
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{
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