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{
"id": "mp-1183401",
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{
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"formula_full": "Sr6 Ca2 V8 O24",
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{
"id": "mp-1080218",
"created_at": "2022-09-04T14:45:15.867347Z",
"structure_string": "Mg2 Mn8 O16\n1.0\n6.085807 0.000000 0.000000\n0.000000 6.091484 0.000000\n0.000000 5.933877 8.161993\nMg Mn O\n2 8 16\ndirect\n0.249268 0.128789 0.125268 Mg\n0.750732 0.128789 0.625268 Mg\n0.495146 0.501889 0.749747 Mn\n0.999034 0.505176 0.245061 Mn\n0.000966 0.505176 0.745061 Mn\n0.504854 0.501889 0.249747 Mn\n0.238439 0.996162 0.502005 Mn\n0.761561 0.996162 0.002005 Mn\n0.243536 0.501484 0.503316 Mn\n0.756464 0.501484 0.003316 Mn\n0.221986 0.737460 0.732782 O\n0.778014 0.737460 0.232782 O\n0.230945 0.298077 0.737383 O\n0.769055 0.298077 0.237383 O\n0.458127 0.717448 0.515799 O\n0.979177 0.709955 0.014106 O\n0.020823 0.709955 0.514106 O\n0.541873 0.717448 0.015799 O\n0.241713 0.716114 0.258675 O\n0.758287 0.716114 0.758675 O\n0.237070 0.260592 0.264299 O\n0.762930 0.260592 0.764299 O\n0.472413 0.276283 0.490135 O\n0.977457 0.275736 0.986703 O\n0.022543 0.275736 0.486703 O\n0.527587 0.276283 0.990135 O\n",
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"formula_full": "Mg2 Mn8 O16",
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"spacegroup": 7
},
{
"id": "mp-1229169",
"created_at": "2022-09-04T14:44:01.579809Z",
"structure_string": "Ca2 Al4 Si32 O76\n1.0\n6.679377 -11.736484 0.000000\n6.679377 11.736484 0.000000\n0.000000 0.000000 14.753672\nCa Al Si O\n2 4 32 76\ndirect\n0.014082 0.985918 0.250000 Ca\n0.985918 0.014082 0.750000 Ca\n0.100706 0.434242 0.750000 Al\n0.565758 0.899294 0.750000 Al\n0.899294 0.565758 0.250000 Al\n0.434242 0.100706 0.250000 Al\n0.002615 0.224185 0.389145 Si\n0.767286 0.766420 0.391372 Si\n0.229975 0.002438 0.392501 Si\n0.997562 0.770025 0.392501 Si\n0.775815 0.997385 0.389145 Si\n0.233580 0.232714 0.391372 Si\n0.997385 0.775815 0.610855 Si\n0.232714 0.233580 0.608628 Si\n0.770025 0.997562 0.607499 Si\n0.002438 0.229975 0.607499 Si\n0.224185 0.002615 0.610855 Si\n0.766420 0.767286 0.608628 Si\n0.997385 0.775815 0.889145 Si\n0.232714 0.233580 0.891372 Si\n0.770025 0.997562 0.892501 Si\n0.002438 0.229975 0.892501 Si\n0.224185 0.002615 0.889145 Si\n0.766420 0.767286 0.891372 Si\n0.002615 0.224185 0.110855 Si\n0.767286 0.766420 0.108628 Si\n0.229975 0.002438 0.107499 Si\n0.997562 0.770025 0.107499 Si\n0.775815 0.997385 0.110855 Si\n0.233580 0.232714 0.108628 Si\n0.570322 0.664066 0.750000 Si\n0.328328 0.908888 0.750000 Si\n0.091112 0.671672 0.750000 Si\n0.335934 0.429678 0.750000 Si\n0.429678 0.335934 0.250000 Si\n0.671672 0.091112 0.250000 Si\n0.908888 0.328328 0.250000 Si\n0.664066 0.570322 0.250000 Si\n0.334303 0.665697 0.429949 O\n0.665697 0.334303 0.570051 O\n0.665697 0.334303 0.929949 O\n0.334303 0.665697 0.070051 O\n0.998028 0.235013 0.497643 O\n0.748954 0.748954 0.500000 O\n0.235013 0.998028 0.502357 O\n0.001972 0.764987 0.502357 O\n0.764987 0.001972 0.497643 O\n0.251046 0.251046 0.500000 O\n0.001972 0.764987 0.997643 O\n0.251046 0.251046 0.000000 O\n0.764987 0.001972 0.002357 O\n0.998028 0.235013 0.002357 O\n0.235013 0.998028 0.997643 O\n0.748954 0.748954 0.000000 O\n0.095365 0.185485 0.864351 O\n0.814515 0.904635 0.864351 O\n0.086497 0.913503 0.858843 O\n0.904635 0.814515 0.135649 O\n0.185485 0.095365 0.135649 O\n0.913503 0.086497 0.141157 O\n0.904635 0.814515 0.364351 O\n0.185485 0.095365 0.364351 O\n0.913503 0.086497 0.358843 O\n0.095365 0.185485 0.635649 O\n0.814515 0.904635 0.635649 O\n0.086497 0.913503 0.641157 O\n0.469099 0.530901 0.750000 O\n0.450038 0.920174 0.750000 O\n0.079826 0.549962 0.750000 O\n0.530901 0.469099 0.250000 O\n0.549962 0.079826 0.250000 O\n0.920174 0.450038 0.250000 O\n0.033688 0.347119 0.846088 O\n0.649642 0.678747 0.840354 O\n0.310676 0.972109 0.839552 O\n0.027891 0.689324 0.839552 O\n0.652881 0.966312 0.846088 O\n0.321253 0.350358 0.840354 O\n0.966312 0.652881 0.153912 O\n0.350358 0.321253 0.159646 O\n0.689324 0.027891 0.160448 O\n0.972109 0.310676 0.160448 O\n0.347119 0.033688 0.153912 O\n0.678747 0.649642 0.159646 O\n0.966312 0.652881 0.346088 O\n0.350358 0.321253 0.340354 O\n0.689324 0.027891 0.339552 O\n0.972109 0.310676 0.339552 O\n0.347119 0.033688 0.346088 O\n0.678747 0.649642 0.340354 O\n0.033688 0.347119 0.653912 O\n0.649642 0.678747 0.659646 O\n0.310676 0.972109 0.660448 O\n0.027891 0.689324 0.660448 O\n0.652881 0.966312 0.653912 O\n0.321253 0.350358 0.659646 O\n0.245401 0.471453 0.750000 O\n0.528547 0.754599 0.750000 O\n0.224403 0.775597 0.750000 O\n0.754599 0.528547 0.250000 O\n0.471453 0.245401 0.250000 O\n0.775597 0.224403 0.250000 O\n0.128501 0.249281 0.143429 O\n0.750719 0.871499 0.143429 O\n0.117164 0.882836 0.144797 O\n0.871499 0.750719 0.856571 O\n0.249281 0.128501 0.856571 O\n0.882836 0.117164 0.855203 O\n0.871499 0.750719 0.643429 O\n0.249281 0.128501 0.643429 O\n0.882836 0.117164 0.644797 O\n0.128501 0.249281 0.356571 O\n0.750719 0.871499 0.356571 O\n0.117164 0.882836 0.355203 O\n",
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"formula_full": "Ca2 Al4 Si32 O76",
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"spacegroup": 63
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{
"id": "mp-1019528",
"created_at": "2022-09-04T14:48:23.269876Z",
"structure_string": "Ba2 Mg1 B6 O12\n1.0\n6.050403 -3.574721 0.000000\n6.050403 3.574721 0.000000\n3.938373 0.000000 5.820242\nBa Mg B O\n2 1 6 12\ndirect\n0.790957 0.790957 0.790957 Ba\n0.209043 0.209043 0.209043 Ba\n0.000000 0.000000 0.000000 Mg\n0.635424 0.354991 0.244198 B\n0.354991 0.244198 0.635424 B\n0.244198 0.635424 0.354991 B\n0.364576 0.645009 0.755802 B\n0.645009 0.755802 0.364576 B\n0.755802 0.364576 0.645009 B\n0.086159 0.840818 0.310436 O\n0.840818 0.310436 0.086159 O\n0.310436 0.086159 0.840818 O\n0.913841 0.159182 0.689564 O\n0.159182 0.689564 0.913841 O\n0.689564 0.913841 0.159182 O\n0.465523 0.572864 0.196500 O\n0.572864 0.196500 0.465523 O\n0.196500 0.465523 0.572864 O\n0.534477 0.427136 0.803500 O\n0.427136 0.803500 0.534477 O\n0.803500 0.534477 0.427136 O\n",
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{
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{
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