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{
"id": "jvasp-9175",
"created_at": "2022-09-04T14:37:09.808279Z",
"updated_at": "2022-09-04T14:37:09.808297Z",
"structure_string": "Zn8 Sb8\n1.0\n6.322838 0.000000 0.000000\n0.000000 7.807475 0.000000\n0.000000 0.000000 8.195327\nZn Sb\n8 8\ndirect\n0.456157 0.107910 0.872744 Zn\n0.956157 0.392090 0.127257 Zn\n0.543843 0.607911 0.627257 Zn\n0.043843 0.892090 0.372744 Zn\n0.543843 0.892090 0.127257 Zn\n0.043843 0.607911 0.872744 Zn\n0.456157 0.392090 0.372744 Zn\n0.956157 0.107910 0.627257 Zn\n0.141801 0.083505 0.109522 Sb\n0.641801 0.416495 0.890479 Sb\n0.858199 0.583506 0.390479 Sb\n0.358199 0.916495 0.609522 Sb\n0.858199 0.916495 0.890479 Sb\n0.358199 0.583506 0.109522 Sb\n0.141801 0.416495 0.609522 Sb\n0.641801 0.083505 0.390479 Sb\n",
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{
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"structure_string": "Zn8 Se4 Cl8 O12\n1.0\n7.652469 0.089822 0.000000\n-1.243772 7.530512 0.000000\n0.000000 0.000000 10.343143\nZn Se Cl O\n8 4 8 12\ndirect\n0.886338 0.234909 0.987908 Zn\n0.879101 0.923337 0.723909 Zn\n0.613662 0.765090 0.487908 Zn\n0.620900 0.076662 0.223909 Zn\n0.113662 0.765090 0.012092 Zn\n0.120900 0.076662 0.276091 Zn\n0.379101 0.923337 0.776091 Zn\n0.386338 0.234909 0.512092 Zn\n0.312705 0.190587 0.032371 Se\n0.812705 0.190587 0.467629 Se\n0.187295 0.809412 0.532371 Se\n0.687295 0.809412 0.967629 Se\n0.271445 0.590070 0.904656 Cl\n0.035928 0.765821 0.221408 Cl\n0.228555 0.409929 0.404656 Cl\n0.535928 0.765821 0.278592 Cl\n0.728555 0.409929 0.095344 Cl\n0.771445 0.590070 0.595344 Cl\n0.964072 0.234179 0.778592 Cl\n0.464072 0.234179 0.721408 Cl\n0.282214 0.984999 0.953159 O\n0.874326 0.122754 0.315894 O\n0.900106 0.804390 0.910593 O\n0.717786 0.015000 0.046841 O\n0.400106 0.804390 0.589407 O\n0.217786 0.015000 0.453159 O\n0.782214 0.984999 0.546841 O\n0.125674 0.877246 0.684106 O\n0.599894 0.195610 0.410593 O\n0.625674 0.877246 0.815893 O\n0.099894 0.195610 0.089407 O\n0.374326 0.122754 0.184106 O\n",
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{
"id": "jvasp-21045",
"created_at": "2022-09-04T14:38:34.370810Z",
"updated_at": "2022-09-04T14:38:34.370834Z",
"structure_string": "Zn8 Se8 O24\n1.0\n6.261640 -0.000000 0.000000\n-0.000000 7.175826 0.000000\n0.000000 0.000000 12.139121\nZn Se O\n8 8 24\ndirect\n0.863043 0.393070 0.595069 Zn\n0.363043 0.606931 0.904931 Zn\n0.636957 0.893070 0.404931 Zn\n0.136957 0.106931 0.095069 Zn\n0.136957 0.606931 0.404931 Zn\n0.636957 0.393070 0.095069 Zn\n0.363043 0.106931 0.595069 Zn\n0.863043 0.893070 0.904931 Zn\n0.888778 0.450176 0.855554 Se\n0.388778 0.549825 0.644446 Se\n0.111222 0.049824 0.355554 Se\n0.611222 0.950176 0.144446 Se\n0.611222 0.450176 0.355554 Se\n0.388778 0.049824 0.855554 Se\n0.888778 0.950176 0.644446 Se\n0.111222 0.549825 0.144446 Se\n0.345673 0.539064 0.067602 O\n0.703419 0.038157 0.267348 O\n0.203419 0.961844 0.232652 O\n0.203419 0.461844 0.267348 O\n0.703419 0.538157 0.232652 O\n0.296581 0.961844 0.732652 O\n0.796581 0.038157 0.767348 O\n0.654327 0.960937 0.567602 O\n0.154327 0.039064 0.932398 O\n0.845673 0.460937 0.432398 O\n0.345673 0.039064 0.432398 O\n0.982922 0.849562 0.408533 O\n0.154327 0.539064 0.567602 O\n0.654327 0.460937 0.932398 O\n0.017078 0.150438 0.591467 O\n0.517078 0.849562 0.908533 O\n0.482922 0.650439 0.408533 O\n0.982922 0.349562 0.091467 O\n0.296581 0.461844 0.767348 O\n0.482922 0.150438 0.091467 O\n0.517078 0.349562 0.591467 O\n0.017078 0.650439 0.908533 O\n0.845673 0.960937 0.067602 O\n0.796581 0.538157 0.732652 O\n",
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"formula_full": "Zn8 Se8 O24",
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},
{
"id": "jvasp-35208",
"created_at": "2022-09-04T14:38:05.206272Z",
"updated_at": "2022-09-04T14:38:05.206299Z",
"structure_string": "Zn8 Si4 O16\n1.0\n-5.801410 0.000000 0.000000\n-2.900706 -5.816734 -4.241363\n-2.900706 -5.816734 4.241363\nZn Si O\n8 4 16\ndirect\n0.500001 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n0.750001 0.218796 0.281204 Zn\n0.250002 0.781203 0.718796 Zn\n0.875821 0.624180 0.124180 Zn\n0.624181 0.375820 0.875819 Zn\n0.375821 0.624180 0.124180 Zn\n0.124181 0.375820 0.875819 Zn\n0.879345 0.737884 0.503428 Si\n0.120658 0.262115 0.496571 Si\n0.379343 0.003429 0.237885 Si\n0.620659 0.996571 0.762115 Si\n0.359509 0.368528 0.385600 O\n0.113637 0.631471 0.614400 O\n0.140492 0.114400 0.131472 O\n0.386366 0.885599 0.868528 O\n0.640493 0.631471 0.614400 O\n0.886365 0.368528 0.385600 O\n0.512035 0.230942 0.744991 O\n0.250002 0.535995 0.964004 O\n0.012035 0.244991 0.730942 O\n0.987967 0.755008 0.269058 O\n0.250001 0.035250 0.464749 O\n0.750002 0.964749 0.535250 O\n0.613636 0.114400 0.131472 O\n0.750001 0.464004 0.035996 O\n0.487967 0.769057 0.255009 O\n0.859510 0.885599 0.868528 O\n",
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"density_atomic": 0.09781598421299384,
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{
"id": "jvasp-35209",
"created_at": "2022-09-04T14:37:58.369210Z",
"updated_at": "2022-09-04T14:37:58.369219Z",
"structure_string": "Zn8 Si4 O16\n1.0\n0.000000 5.553072 0.056220\n7.785015 0.000000 0.000000\n0.000000 -4.786520 -7.838373\nZn Si O\n8 4 16\ndirect\n0.238021 0.876983 0.098203 Zn\n0.238021 0.623018 0.598203 Zn\n0.761978 0.123017 0.901797 Zn\n0.761979 0.376983 0.401797 Zn\n0.867669 0.500968 0.810172 Zn\n0.867669 -0.000968 0.310172 Zn\n0.132330 0.499033 0.189828 Zn\n0.132330 0.000968 0.689828 Zn\n0.621890 0.746669 0.462215 Si\n0.621890 0.753332 0.962215 Si\n0.378109 0.253331 0.537784 Si\n0.378110 0.246669 0.037785 Si\n0.387436 0.344077 0.377868 O\n0.387435 0.155923 0.877868 O\n0.828331 0.629615 0.422481 O\n0.828330 0.870386 0.922481 O\n0.171669 0.370386 0.577519 O\n0.171669 0.129615 0.077519 O\n0.291854 0.736904 0.293370 O\n0.245537 0.057005 0.506950 O\n0.708145 0.263096 0.706630 O\n0.708145 0.236904 0.206630 O\n0.754462 0.942996 0.493050 O\n0.754462 0.557005 0.993049 O\n0.612564 0.844077 0.122131 O\n0.245537 0.442995 0.006950 O\n0.291854 0.763097 0.793369 O\n0.612564 0.655924 0.622131 O\n",
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{
"id": "jvasp-35188",
"created_at": "2022-09-04T14:38:06.802804Z",
"updated_at": "2022-09-04T14:38:06.802830Z",
"structure_string": "Zn8 Si4 O16\n1.0\n4.841702 -0.000000 0.000000\n-0.000000 6.080083 0.000000\n0.000000 0.000000 10.369486\nZn Si O\n8 4 16\ndirect\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n0.483465 0.750000 0.780953 Zn\n0.016535 0.750000 0.280953 Zn\n0.516535 0.250000 0.219047 Zn\n0.983465 0.250000 0.719048 Zn\n0.427985 0.250000 0.903479 Si\n0.072014 0.250000 0.403478 Si\n0.572014 0.750000 0.096522 Si\n0.927985 0.750000 0.596522 Si\n0.281204 0.467162 0.835237 O\n0.218796 0.032837 0.335237 O\n0.281204 0.032837 0.835237 O\n0.218796 0.467162 0.335237 O\n0.718796 0.532837 0.164763 O\n0.781204 0.967162 0.664764 O\n0.216792 0.250000 0.551240 O\n0.233812 0.750000 0.093100 O\n0.783207 0.750000 0.448760 O\n0.716792 0.750000 0.948761 O\n0.766187 0.250000 0.906901 O\n0.733812 0.250000 0.406901 O\n0.781204 0.532837 0.664764 O\n0.266188 0.750000 0.593100 O\n0.283208 0.250000 0.051240 O\n0.718796 0.967162 0.164763 O\n",
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{
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