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{
"id": "mp-1176199",
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{
"id": "mp-543107",
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"structure_string": "Fe8 As12 O48\n1.0\n8.697212 0.002645 0.000000\n-0.160201 12.326260 0.000000\n0.000000 0.000000 8.999182\nFe As O\n8 12 48\ndirect\n0.250087 0.884903 0.024984 Fe\n0.249913 0.615097 0.524984 Fe\n0.253913 0.382900 0.971592 Fe\n0.246087 0.117100 0.471592 Fe\n0.753913 0.882900 0.528408 Fe\n0.746087 0.617100 0.028408 Fe\n0.750087 0.384903 0.475016 Fe\n0.749913 0.115097 0.975016 Fe\n0.036964 0.491261 0.250603 As\n0.111636 0.848136 0.378421 As\n0.113312 0.139851 0.112538 As\n0.388364 0.651864 0.878421 As\n0.386688 0.360149 0.612538 As\n0.463036 0.008739 0.750603 As\n0.536964 0.991261 0.249397 As\n0.613312 0.639851 0.387462 As\n0.611636 0.348136 0.121579 As\n0.886688 0.860149 0.887462 As\n0.888364 0.151864 0.621579 As\n0.963036 0.508739 0.749397 As\n0.059833 0.439376 0.884893 O\n0.073087 0.906781 0.884106 O\n0.072706 0.611716 0.671686 O\n0.071928 0.189632 0.574151 O\n0.096853 0.594569 0.365792 O\n0.115711 0.837720 0.187249 O\n0.138147 0.982378 0.422906 O\n0.127010 0.247434 0.992046 O\n0.167324 0.186239 0.285267 O\n0.194294 0.429904 0.175528 O\n0.242488 0.772832 0.474788 O\n0.257512 0.727168 0.974788 O\n0.244844 0.044248 0.056669 O\n0.255156 0.455752 0.556669 O\n0.305706 0.070096 0.675528 O\n0.332676 0.313761 0.785267 O\n0.361853 0.517622 0.922906 O\n0.372990 0.252566 0.492046 O\n0.384289 0.662280 0.687249 O\n0.403147 0.905431 0.865792 O\n0.427294 0.888284 0.171686 O\n0.426913 0.593219 0.384106 O\n0.428072 0.310368 0.074151 O\n0.440167 0.060624 0.384893 O\n0.559833 0.939376 0.615107 O\n0.571928 0.689632 0.925849 O\n0.573087 0.406781 0.615894 O\n0.572706 0.111716 0.828314 O\n0.596853 0.094569 0.134208 O\n0.615711 0.337720 0.312751 O\n0.627010 0.747434 0.507954 O\n0.638147 0.482378 0.077094 O\n0.667324 0.686239 0.214733 O\n0.694294 0.929904 0.324472 O\n0.744844 0.544248 0.443331 O\n0.755156 0.955752 0.943331 O\n0.742488 0.272832 0.025212 O\n0.757512 0.227168 0.525212 O\n0.805706 0.570096 0.824472 O\n0.832676 0.813761 0.714733 O\n0.872990 0.752566 0.007954 O\n0.861853 0.017622 0.577094 O\n0.884289 0.162280 0.812751 O\n0.903147 0.405431 0.634208 O\n0.928072 0.810368 0.425849 O\n0.927294 0.388284 0.328314 O\n0.926913 0.093219 0.115894 O\n0.940167 0.560624 0.115107 O\n",
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{
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"created_at": "2022-09-04T14:40:00.618562Z",
"structure_string": "Ba2 Nb2 I10 O32\n1.0\n3.818591 7.166060 0.000000\n-3.818591 7.166060 0.000000\n0.000000 6.054190 14.023491\nBa Nb I O\n2 2 10 32\ndirect\n0.979387 0.265523 0.504719 Ba\n0.265523 0.979387 0.004719 Ba\n0.408798 0.465189 0.911219 Nb\n0.465189 0.408798 0.411219 Nb\n0.415323 0.763601 0.670629 I\n0.763601 0.415323 0.170629 I\n0.025893 0.712749 0.576297 I\n0.712749 0.025893 0.076297 I\n0.914320 0.230436 0.782238 I\n0.230436 0.914320 0.282238 I\n0.127757 0.532628 0.230965 I\n0.532628 0.127757 0.730965 I\n0.900859 0.653805 0.889538 I\n0.653805 0.900859 0.389538 I\n0.179433 0.594387 0.665876 O\n0.594387 0.179433 0.165876 O\n0.798183 0.026350 0.669640 O\n0.026350 0.798183 0.169640 O\n0.310987 0.531756 0.277987 O\n0.531756 0.310987 0.777987 O\n0.191046 0.008697 0.649684 O\n0.008697 0.191046 0.149684 O\n0.888523 0.111609 0.000448 O\n0.111609 0.888523 0.500448 O\n0.154258 0.445924 0.927677 O\n0.445924 0.154258 0.427677 O\n0.884177 0.408562 0.668140 O\n0.408562 0.884177 0.168140 O\n0.313478 0.717319 0.803230 O\n0.717319 0.313478 0.303230 O\n0.693060 0.423611 0.856855 O\n0.423611 0.693060 0.356855 O\n0.336222 0.610286 0.994986 O\n0.610286 0.336222 0.494986 O\n0.556387 0.936060 0.841678 O\n0.936060 0.556387 0.341678 O\n0.185204 0.508713 0.497603 O\n0.508713 0.185204 0.997603 O\n0.106420 0.233773 0.815019 O\n0.233773 0.106420 0.315019 O\n0.733183 0.602839 0.997108 O\n0.602839 0.733183 0.497108 O\n0.895216 0.861051 0.911298 O\n0.861051 0.895216 0.411298 O\n0.578102 0.851139 0.670705 O\n0.851139 0.578102 0.170705 O\n",
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{
"id": "mp-1195841",
"created_at": "2022-09-04T14:40:00.623222Z",
"structure_string": "V4 Pb8 Se12 O40\n1.0\n16.335863 0.000000 0.000000\n0.000000 5.292796 0.000000\n0.000000 5.198837 11.481803\nV Pb Se O\n4 8 12 40\ndirect\n0.807358 0.181745 0.059646 V\n0.692642 0.181745 0.559646 V\n0.192642 0.818255 0.940354 V\n0.307358 0.818255 0.440354 V\n0.586142 0.202949 0.066388 Pb\n0.913858 0.202949 0.566388 Pb\n0.413858 0.797051 0.933612 Pb\n0.086142 0.797051 0.433612 Pb\n0.509531 0.563739 0.683311 Pb\n0.990469 0.563739 0.183311 Pb\n0.490469 0.436261 0.316689 Pb\n0.009531 0.436261 0.816689 Pb\n0.373844 0.099061 0.156977 Se\n0.126156 0.099061 0.656977 Se\n0.626156 0.900939 0.843023 Se\n0.873844 0.900939 0.343023 Se\n0.646125 0.816006 0.413374 Se\n0.853875 0.816006 0.913374 Se\n0.353875 0.183994 0.586626 Se\n0.146125 0.183994 0.086626 Se\n0.791060 0.537224 0.704999 Se\n0.708940 0.537224 0.204999 Se\n0.208940 0.462776 0.295001 Se\n0.291060 0.462776 0.795001 Se\n0.570890 0.858844 0.312874 O\n0.929110 0.858844 0.812874 O\n0.429110 0.141156 0.687126 O\n0.070890 0.141156 0.187126 O\n0.448229 0.357785 0.096553 O\n0.051771 0.357785 0.596553 O\n0.551771 0.642215 0.903447 O\n0.948229 0.642215 0.403447 O\n0.751500 0.248051 0.193806 O\n0.748500 0.248051 0.693806 O\n0.248500 0.751949 0.806194 O\n0.251500 0.751949 0.306194 O\n0.613946 0.065725 0.463467 O\n0.886054 0.065725 0.963467 O\n0.386054 0.934275 0.536533 O\n0.113946 0.934275 0.036533 O\n0.382241 0.067618 0.299697 O\n0.117759 0.067618 0.799697 O\n0.617759 0.932382 0.700303 O\n0.882241 0.932382 0.200303 O\n0.570803 0.177211 0.844238 O\n0.929197 0.177211 0.344238 O\n0.429197 0.822789 0.155762 O\n0.070803 0.822789 0.655762 O\n0.736281 0.367149 0.962319 O\n0.763719 0.367149 0.462319 O\n0.263719 0.632851 0.037681 O\n0.236281 0.632851 0.537681 O\n0.613184 0.505361 0.528785 O\n0.886816 0.505361 0.028785 O\n0.386816 0.494639 0.471215 O\n0.113184 0.494639 0.971215 O\n0.608936 0.516341 0.160946 O\n0.891064 0.516341 0.660946 O\n0.391064 0.483659 0.839054 O\n0.108936 0.483659 0.339054 O\n0.758572 0.823396 0.584792 O\n0.741428 0.823396 0.084792 O\n0.241428 0.176604 0.415208 O\n0.258572 0.176604 0.915208 O\n",
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"formula_full": "V4 Pb8 Se12 O40",
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{
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"structure_string": "Er5 Mg1\n1.0\n5.788169 -3.038010 0.000000\n5.788169 3.038010 0.000000\n4.193623 0.000000 5.014572\nEr Mg\n5 1\ndirect\n0.500000 0.162570 0.837430 Er\n0.162570 0.837430 0.500000 Er\n0.837430 0.500000 0.162570 Er\n0.332181 0.332181 0.332181 Er\n0.667819 0.667819 0.667819 Er\n0.000000 0.000000 0.000000 Mg\n",
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{
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"structure_string": "Sr4 Tb4 O12\n1.0\n6.048345 0.000000 0.000000\n0.000000 6.226708 0.000000\n0.000000 0.000000 8.597645\nSr Tb O\n4 4 12\ndirect\n0.983327 0.050689 0.250000 Sr\n0.483327 0.449311 0.750000 Sr\n0.516673 0.550689 0.250000 Sr\n0.016673 0.949311 0.750000 Sr\n0.500000 0.000000 0.000000 Tb\n0.000000 0.500000 0.000000 Tb\n0.000000 0.500000 0.500000 Tb\n0.500000 0.000000 0.500000 Tb\n0.202799 0.205400 0.560387 O\n0.702799 0.294600 0.439613 O\n0.297201 0.705400 0.939613 O\n0.797201 0.794600 0.060387 O\n0.797201 0.794600 0.439613 O\n0.297201 0.705400 0.560387 O\n0.702799 0.294600 0.060387 O\n0.202799 0.205400 0.939613 O\n0.113051 0.449694 0.250000 O\n0.613051 0.050306 0.750000 O\n0.386949 0.949694 0.250000 O\n0.886949 0.550306 0.750000 O\n",
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{
"id": "mp-1040126",
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"structure_string": "Li1 La1 Mg30 O32\n1.0\n8.608116 0.000000 0.000000\n0.000000 8.608116 0.000000\n0.000000 0.000000 8.600410\nLi La Mg O\n1 1 30 32\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.500000 La\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\n0.254897 0.000000 0.238118 Mg\n0.254897 0.000000 0.761882 Mg\n0.745103 0.000000 0.238118 Mg\n0.745103 0.000000 0.761882 Mg\n0.250136 0.500000 0.248044 Mg\n0.250136 0.500000 0.751956 Mg\n0.749864 0.500000 0.248044 Mg\n0.749864 0.500000 0.751956 Mg\n0.000000 0.254897 0.238118 Mg\n0.000000 0.254897 0.761882 Mg\n0.500000 0.250136 0.248044 Mg\n0.500000 0.250136 0.751956 Mg\n0.000000 0.745103 0.238118 Mg\n0.000000 0.745103 0.761882 Mg\n0.500000 0.749864 0.248044 Mg\n0.500000 0.749864 0.751956 Mg\n0.247602 0.247602 0.000000 Mg\n0.257738 0.257738 0.500000 Mg\n0.752398 0.247602 0.000000 Mg\n0.742262 0.257738 0.500000 Mg\n0.247602 0.752398 0.000000 Mg\n0.257738 0.742262 0.500000 Mg\n0.752398 0.752398 0.000000 Mg\n0.742262 0.742262 0.500000 Mg\n0.000000 0.260800 0.000000 O\n0.000000 0.268162 0.500000 O\n0.500000 0.251838 0.000000 O\n0.500000 0.253265 0.500000 O\n0.000000 0.739200 0.000000 O\n0.000000 0.731838 0.500000 O\n0.500000 0.748162 0.000000 O\n0.500000 0.746735 0.500000 O\n0.249222 0.249222 0.251381 O\n0.249222 0.249222 0.748619 O\n0.750778 0.249222 0.251381 O\n0.750778 0.249222 0.748619 O\n0.249222 0.750778 0.251381 O\n0.249222 0.750778 0.748619 O\n0.750778 0.750778 0.251381 O\n0.750778 0.750778 0.748619 O\n0.000000 0.000000 0.232770 O\n0.000000 0.000000 0.767230 O\n0.500000 0.000000 0.248862 O\n0.500000 0.000000 0.751138 O\n0.000000 0.500000 0.248862 O\n0.000000 0.500000 0.751138 O\n0.500000 0.500000 0.250226 O\n0.500000 0.500000 0.749774 O\n0.260800 0.000000 0.000000 O\n0.268162 0.000000 0.500000 O\n0.739200 0.000000 0.000000 O\n0.731838 0.000000 0.500000 O\n0.251838 0.500000 0.000000 O\n0.253265 0.500000 0.500000 O\n0.748162 0.500000 0.000000 O\n0.746735 0.500000 0.500000 O\n",
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