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{
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{
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{
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"structure_string": "Sr4 Ir3 O10\n1.0\n-1.993588 1.993588 14.389768\n1.993588 -1.993588 14.389768\n1.993588 1.993588 -14.389768\nSr Ir O\n4 3 10\ndirect\n0.298314 0.298314 0.000000 Sr\n0.701686 0.701686 0.000000 Sr\n0.431096 0.431096 0.000000 Sr\n0.568904 0.568904 0.000000 Sr\n0.142510 0.142510 0.000000 Ir\n0.857490 0.857490 0.000000 Ir\n0.000000 0.000000 0.000000 Ir\n0.212989 0.212989 0.000000 O\n0.787011 0.787011 0.000000 O\n0.637121 0.137121 0.500000 O\n0.362879 0.862879 0.500000 O\n0.137121 0.637121 0.500000 O\n0.862879 0.362879 0.500000 O\n0.069756 0.069756 0.000000 O\n0.930244 0.930244 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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"formula_full": "Sr4 Ir3 O10",
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{
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"structure_string": "Mg30 Cd1 Fe1 O32\n1.0\n8.576925 0.000000 0.000000\n0.000000 8.576925 0.000000\n0.000000 0.000000 8.562230\nMg Cd Fe O\n30 1 1 32\ndirect\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.253389 0.000000 0.247914 Mg\n0.253389 0.000000 0.752086 Mg\n0.746611 0.000000 0.247914 Mg\n0.746611 0.000000 0.752086 Mg\n0.249979 0.500000 0.249764 Mg\n0.249979 0.500000 0.750236 Mg\n0.750021 0.500000 0.249764 Mg\n0.750021 0.500000 0.750236 Mg\n0.000000 0.253389 0.247914 Mg\n0.000000 0.253389 0.752086 Mg\n0.500000 0.249979 0.249764 Mg\n0.500000 0.249979 0.750236 Mg\n0.000000 0.746611 0.247914 Mg\n0.000000 0.746611 0.752086 Mg\n0.500000 0.750021 0.249764 Mg\n0.500000 0.750021 0.750236 Mg\n0.249605 0.249605 0.000000 Mg\n0.252175 0.252175 0.500000 Mg\n0.750395 0.249605 0.000000 Mg\n0.747825 0.252175 0.500000 Mg\n0.249605 0.750395 0.000000 Mg\n0.252175 0.747825 0.500000 Mg\n0.750395 0.750395 0.000000 Mg\n0.747825 0.747825 0.500000 Mg\n0.000000 0.000000 0.500000 Cd\n0.000000 0.000000 0.000000 Fe\n0.000000 0.257589 0.000000 O\n0.000000 0.263400 0.500000 O\n0.500000 0.250819 0.000000 O\n0.500000 0.251712 0.500000 O\n0.000000 0.742411 0.000000 O\n0.000000 0.736600 0.500000 O\n0.500000 0.749181 0.000000 O\n0.500000 0.748288 0.500000 O\n0.249145 0.249145 0.250496 O\n0.249145 0.249145 0.749504 O\n0.750855 0.249145 0.250496 O\n0.750855 0.249145 0.749504 O\n0.249145 0.750855 0.250496 O\n0.249145 0.750855 0.749504 O\n0.750855 0.750855 0.250496 O\n0.750855 0.750855 0.749504 O\n0.000000 0.000000 0.237415 O\n0.000000 0.000000 0.762585 O\n0.500000 0.000000 0.249041 O\n0.500000 0.000000 0.750959 O\n0.000000 0.500000 0.249041 O\n0.000000 0.500000 0.750959 O\n0.500000 0.500000 0.250009 O\n0.500000 0.500000 0.749991 O\n0.257589 0.000000 0.000000 O\n0.263400 0.000000 0.500000 O\n0.742411 0.000000 0.000000 O\n0.736600 0.000000 0.500000 O\n0.250819 0.500000 0.000000 O\n0.251712 0.500000 0.500000 O\n0.749181 0.500000 0.000000 O\n0.748288 0.500000 0.500000 O\n",
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{
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"created_at": "2022-09-04T14:46:13.744117Z",
"structure_string": "K2 Co2 O4\n1.0\n-0.118328 0.182794 5.561579\n1.788128 4.628038 2.528612\n-3.053145 4.625841 -0.507129\nK Co O\n2 2 4\ndirect\n0.250008 0.500000 0.750008 K\n0.499921 0.999999 0.499923 K\n0.000139 0.000008 0.000140 Co\n0.750008 0.500012 0.249996 Co\n0.374534 0.860923 0.990762 O\n0.851692 0.139071 0.235468 O\n0.765022 0.382840 0.625825 O\n0.008677 0.617148 0.147878 O\n",
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{
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{
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{
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{
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{
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{
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],
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"volume_molar": 17.650287125667536,
"formula_full": "Eu2 Tl1 Zn1",
"formula_reduced": "Eu2TlZn",
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{
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}