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{
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{
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{
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{
"id": "mp-560496",
"created_at": "2022-09-04T14:46:07.226564Z",
"structure_string": "Ba4 V8 Zn4 O28\n1.0\n15.416643 0.000000 0.000000\n0.000000 5.667171 0.000000\n0.000000 4.793939 7.557135\nBa V Zn O\n4 8 4 28\ndirect\n0.784718 0.430057 0.354627 Ba\n0.715282 0.430057 0.854627 Ba\n0.215282 0.569943 0.645373 Ba\n0.284718 0.569943 0.145373 Ba\n0.866194 0.918648 0.833099 V\n0.633806 0.918648 0.333099 V\n0.133806 0.081352 0.166901 V\n0.366194 0.081352 0.666901 V\n0.062017 0.916912 0.787309 V\n0.437983 0.916912 0.287309 V\n0.937983 0.083088 0.212691 V\n0.562017 0.083088 0.712691 V\n0.550772 0.577476 0.131127 Zn\n0.949228 0.577476 0.631127 Zn\n0.449228 0.422524 0.868873 Zn\n0.050772 0.422524 0.368873 Zn\n0.783086 0.768057 0.977621 O\n0.716914 0.768057 0.477621 O\n0.216914 0.231943 0.022379 O\n0.283086 0.231943 0.522379 O\n0.971650 0.814401 0.941170 O\n0.528350 0.814401 0.441170 O\n0.028350 0.185599 0.058830 O\n0.471650 0.185599 0.558830 O\n0.160192 0.845950 0.883546 O\n0.339808 0.845950 0.383546 O\n0.839808 0.154050 0.116454 O\n0.660192 0.154050 0.616454 O\n0.051977 0.740295 0.679187 O\n0.448023 0.740295 0.179187 O\n0.948023 0.259705 0.320813 O\n0.551977 0.259705 0.820813 O\n0.053877 0.279953 0.630697 O\n0.446123 0.279953 0.130697 O\n0.946123 0.720047 0.369303 O\n0.553877 0.720047 0.869303 O\n0.856584 0.284702 0.710341 O\n0.643416 0.284702 0.210341 O\n0.143416 0.715298 0.289659 O\n0.356584 0.715298 0.789659 O\n0.861815 0.801241 0.691232 O\n0.638185 0.801241 0.191232 O\n0.138185 0.198759 0.308768 O\n0.361815 0.198759 0.808768 O\n",
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"volume": 660.2574546049209,
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"formula_full": "Ba4 V8 Zn4 O28",
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{
"id": "mp-1196807",
"created_at": "2022-09-04T14:46:04.453441Z",
"structure_string": "In4 C16 Br28 N16\n1.0\n7.535328 0.000000 0.000000\n0.000000 16.412490 0.000000\n0.000000 12.872914 16.185973\nIn C Br N\n4 16 28 16\ndirect\n0.000000 0.000000 0.500000 In\n0.000000 0.000000 0.000000 In\n0.000000 0.500000 0.000000 In\n0.000000 0.500000 0.500000 In\n0.519213 0.329513 0.970331 C\n0.519213 0.670487 0.529669 C\n0.480787 0.670487 0.029669 C\n0.480787 0.329513 0.470331 C\n0.494394 0.826631 0.197731 C\n0.494394 0.173369 0.302269 C\n0.505606 0.173369 0.802269 C\n0.505606 0.826631 0.697731 C\n0.901225 0.141765 0.642412 C\n0.901225 0.858235 0.857588 C\n0.098775 0.858235 0.357588 C\n0.098775 0.141765 0.142412 C\n0.903905 0.364291 0.780589 C\n0.903905 0.635709 0.719411 C\n0.096095 0.635709 0.219411 C\n0.096095 0.364291 0.280589 C\n0.755043 0.135120 0.473508 Br\n0.755043 0.864880 0.026492 Br\n0.244957 0.864880 0.526492 Br\n0.244957 0.135120 0.973508 Br\n0.254030 0.126169 0.483032 Br\n0.254030 0.873831 0.016968 Br\n0.745970 0.873831 0.516968 Br\n0.745970 0.126169 0.983032 Br\n0.228665 0.641323 0.885082 Br\n0.228665 0.358677 0.614918 Br\n0.771335 0.358677 0.114918 Br\n0.771335 0.641323 0.385082 Br\n0.613630 0.000000 0.250000 Br\n0.386370 0.000000 0.750000 Br\n0.989773 0.904163 0.662321 Br\n0.989773 0.095837 0.837679 Br\n0.010227 0.095837 0.337679 Br\n0.010227 0.904163 0.162321 Br\n0.986991 0.599423 0.064480 Br\n0.986991 0.400577 0.435520 Br\n0.013009 0.400577 0.935520 Br\n0.013009 0.599423 0.564480 Br\n0.734172 0.617119 0.897278 Br\n0.734172 0.382881 0.602722 Br\n0.265828 0.382881 0.102722 Br\n0.265828 0.617119 0.397278 Br\n0.613549 0.500000 0.250000 Br\n0.386451 0.500000 0.750000 Br\n0.501601 0.917710 0.144642 N\n0.501601 0.082290 0.355358 N\n0.498399 0.082290 0.855358 N\n0.498399 0.917710 0.644642 N\n0.479374 0.416598 0.939069 N\n0.479374 0.583402 0.560931 N\n0.520626 0.583402 0.060931 N\n0.520626 0.416598 0.439069 N\n0.048430 0.155923 0.617988 N\n0.048430 0.844077 0.882012 N\n0.951570 0.844077 0.382012 N\n0.951570 0.155923 0.117988 N\n0.051664 0.342144 0.778269 N\n0.051664 0.657856 0.721731 N\n0.948336 0.657856 0.221731 N\n0.948336 0.342144 0.278269 N\n",
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{
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"structure_string": "Ca4 Mn2 Al4 Si6 H2 O26\n1.0\n5.763042 0.000000 0.000000\n0.000000 8.945599 0.000000\n0.000000 4.419241 9.245752\nCa Mn Al Si H O\n4 2 4 6 2 26\ndirect\n0.250000 0.246212 0.153211 Ca\n0.750000 0.753788 0.846789 Ca\n0.250000 0.402700 0.427443 Ca\n0.750000 0.597300 0.572557 Ca\n0.750000 0.703858 0.220751 Mn\n0.250000 0.296142 0.779249 Mn\n0.500000 0.000000 0.000000 Al\n0.000000 0.000000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.000000 0.500000 Al\n0.250000 0.660998 0.045199 Si\n0.750000 0.339002 0.954801 Si\n0.750000 0.315375 0.273874 Si\n0.250000 0.684625 0.726126 Si\n0.250000 0.813397 0.319696 Si\n0.750000 0.186603 0.680304 Si\n0.750000 0.940837 0.330232 H\n0.250000 0.059163 0.669768 H\n0.490211 0.770644 0.031979 O\n0.990211 0.229356 0.968021 O\n0.509789 0.229356 0.968021 O\n0.009789 0.770644 0.031979 O\n0.478114 0.691896 0.358317 O\n0.978114 0.308104 0.641683 O\n0.521886 0.308104 0.641683 O\n0.021886 0.691896 0.358317 O\n0.517292 0.202182 0.335332 O\n0.017292 0.797818 0.664668 O\n0.482708 0.797818 0.664668 O\n0.982708 0.202182 0.335332 O\n0.750000 0.940709 0.131134 O\n0.250000 0.059291 0.868866 O\n0.250000 0.955196 0.145028 O\n0.750000 0.044804 0.854972 O\n0.250000 0.931410 0.408245 O\n0.750000 0.068590 0.591755 O\n0.250000 0.488177 0.184557 O\n0.750000 0.511823 0.815443 O\n0.750000 0.469567 0.316989 O\n0.250000 0.530433 0.683011 O\n0.750000 0.385459 0.095413 O\n0.250000 0.614541 0.904587 O\n0.750000 0.911965 0.434280 O\n0.250000 0.088035 0.565720 O\n",
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{
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{
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{
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