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{
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{
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"created_at": "2022-09-04T14:42:15.161833Z",
"structure_string": "Cs6 Cd2 Br10\n1.0\n-4.930600 4.930600 8.137021\n4.930600 -4.930600 8.137021\n4.930600 4.930600 -8.137021\nCs Cd Br\n6 2 10\ndirect\n0.160693 0.660693 0.821386 Cs\n0.839307 0.339307 0.178614 Cs\n0.660693 0.839307 0.500000 Cs\n0.339307 0.160693 0.500000 Cs\n0.750000 0.750000 0.000000 Cs\n0.250000 0.250000 0.000000 Cs\n0.250000 0.750000 0.500000 Cd\n0.750000 0.250000 0.500000 Cd\n0.799764 0.299764 0.797344 Br\n0.502419 0.002419 0.202656 Br\n0.299764 0.502419 0.500000 Br\n0.002419 0.799764 0.500000 Br\n0.200236 0.700236 0.202656 Br\n0.497581 0.997581 0.797344 Br\n0.700236 0.497581 0.500000 Br\n0.997581 0.200236 0.500000 Br\n0.000000 0.000000 0.000000 Br\n0.500000 0.500000 0.000000 Br\n",
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{
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"volume": 791.2880820042396,
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"formula_full": "Ba6 Sn6 F33",
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{
"id": "mp-1096487",
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"structure_string": "Mn1 Tc2 W1\n1.0\n-4.942725 5.322170 7.520039\n4.942725 -5.322170 7.520039\n4.942725 5.322170 -7.520039\nMn Tc W\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.273450 0.273450 Tc\n0.000000 0.726550 0.726550 Tc\n0.000000 0.500000 0.500000 W\n",
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{
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"created_at": "2022-09-04T14:39:13.410799Z",
"structure_string": "Sm8 Ag8 S16\n1.0\n7.763330 0.000000 0.000000\n0.000000 7.766791 0.000000\n0.000000 0.028255 13.123402\nSm Ag S\n8 8 16\ndirect\n0.504943 0.745702 0.003861 Sm\n0.004943 0.254298 0.996139 Sm\n0.257010 0.003001 0.753166 Sm\n0.757010 0.996999 0.246834 Sm\n0.748278 0.503360 0.746890 Sm\n0.248278 0.496640 0.253110 Sm\n0.002872 0.753010 0.503360 Sm\n0.502872 0.246990 0.496640 Sm\n0.250596 0.498400 0.798519 Ag\n0.750596 0.501600 0.201481 Ag\n0.753175 0.997089 0.689203 Ag\n0.253175 0.002911 0.310797 Ag\n0.001778 0.755181 0.043771 Ag\n0.501778 0.244819 0.956229 Ag\n0.500786 0.741410 0.541495 Ag\n0.000786 0.258590 0.458505 Ag\n0.783584 0.029934 0.462667 S\n0.283584 0.970066 0.537333 S\n0.227847 0.475413 0.469198 S\n0.727847 0.524587 0.530802 S\n0.527924 0.721973 0.219602 S\n0.027924 0.278027 0.780398 S\n0.472559 0.721920 0.788763 S\n0.972559 0.278080 0.211237 S\n0.976834 0.779398 0.718426 S\n0.476834 0.220602 0.281574 S\n0.532874 0.221860 0.711156 S\n0.032874 0.778140 0.288844 S\n0.278948 0.023434 0.968511 S\n0.778948 0.976566 0.031489 S\n0.722993 0.469083 0.961655 S\n0.222993 0.530917 0.038345 S\n",
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"formula_full": "Sm8 Ag8 S16",
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{
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"structure_string": "Ta2 Re1 Pd1\n1.0\n-4.820414 5.393916 7.608369\n4.820414 -5.393916 7.608369\n4.820414 5.393916 -7.608369\nTa Re Pd\n2 1 1\ndirect\n0.000000 0.260633 0.260633 Ta\n0.000000 0.739367 0.739367 Ta\n0.000000 0.500000 0.500000 Re\n0.000000 0.000000 0.000000 Pd\n",
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{
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"structure_string": "K4 La4 Eu4 Sb4 O24\n1.0\n9.211178 0.000000 0.000000\n0.000000 9.197118 0.000000\n0.000000 0.000000 9.340669\nK La Eu Sb O\n4 4 4 4 24\ndirect\n0.000000 0.500000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.500000 0.000000 0.000000 K\n0.000000 0.000000 0.500000 K\n0.750000 0.750000 0.750000 La\n0.250000 0.250000 0.750000 La\n0.250000 0.750000 0.250000 La\n0.750000 0.250000 0.250000 La\n0.500000 0.000000 0.500000 Eu\n0.000000 0.500000 0.000000 Eu\n0.000000 0.000000 0.000000 Eu\n0.500000 0.500000 0.500000 Eu\n0.250000 0.250000 0.250000 Sb\n0.750000 0.750000 0.250000 Sb\n0.750000 0.250000 0.750000 Sb\n0.250000 0.750000 0.750000 Sb\n0.021085 0.201040 0.284874 O\n0.978915 0.798960 0.284874 O\n0.978915 0.201040 0.715126 O\n0.021085 0.798960 0.715126 O\n0.287777 0.020749 0.202693 O\n0.287777 0.979251 0.797307 O\n0.712223 0.979251 0.202693 O\n0.712223 0.020749 0.797307 O\n0.193795 0.291915 0.018750 O\n0.806205 0.291915 0.981250 O\n0.193795 0.708085 0.981250 O\n0.806205 0.708085 0.018750 O\n0.478915 0.298960 0.215126 O\n0.521085 0.701040 0.215126 O\n0.521085 0.298960 0.784874 O\n0.478915 0.701040 0.784874 O\n0.212223 0.479251 0.297307 O\n0.212223 0.520749 0.702693 O\n0.787777 0.520749 0.297307 O\n0.787777 0.479251 0.702693 O\n0.306205 0.208085 0.481250 O\n0.693795 0.208085 0.518750 O\n0.306205 0.791915 0.518750 O\n0.693795 0.791915 0.481250 O\n",
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{
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"created_at": "2022-09-04T14:47:22.379200Z",
"structure_string": "Li16 Mn8 P8 O32 F8\n1.0\n6.558377 0.000000 0.000000\n0.000000 10.758101 0.000000\n0.000000 0.000000 11.216009\nLi Mn P O F\n16 8 8 32 8\ndirect\n0.750000 0.026535 0.271127 Li\n0.250000 0.231421 0.084157 Li\n0.509608 0.240244 0.331836 Li\n0.990392 0.240244 0.331836 Li\n0.009608 0.259756 0.831836 Li\n0.490392 0.259756 0.831836 Li\n0.750000 0.268579 0.584157 Li\n0.250000 0.473465 0.771127 Li\n0.750000 0.526535 0.228873 Li\n0.250000 0.731421 0.415843 Li\n0.509608 0.740244 0.168164 Li\n0.990392 0.740244 0.168164 Li\n0.009608 0.759756 0.668164 Li\n0.490392 0.759756 0.668164 Li\n0.750000 0.768579 0.915843 Li\n0.250000 0.973465 0.728873 Li\n0.000000 0.000000 0.000000 Mn\n0.500000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.500000 Mn\n0.000000 0.500000 0.000000 Mn\n0.500000 0.500000 0.000000 Mn\n0.750000 0.020503 0.745562 P\n0.750000 0.245501 0.080594 P\n0.250000 0.254499 0.580594 P\n0.250000 0.479497 0.245562 P\n0.750000 0.520503 0.754438 P\n0.750000 0.745501 0.419406 P\n0.250000 0.754499 0.919406 P\n0.250000 0.979497 0.254438 P\n0.250000 0.028822 0.123251 O\n0.057278 0.034800 0.315857 O\n0.442722 0.034800 0.315857 O\n0.250000 0.110730 0.562542 O\n0.750000 0.165293 0.744287 O\n0.555013 0.195037 0.017331 O\n0.944987 0.195037 0.017331 O\n0.750000 0.214920 0.215538 O\n0.250000 0.285080 0.715538 O\n0.055013 0.304963 0.517331 O\n0.444987 0.304963 0.517331 O\n0.250000 0.334707 0.244287 O\n0.750000 0.389270 0.062542 O\n0.557278 0.465200 0.815857 O\n0.942722 0.465200 0.815857 O\n0.750000 0.471178 0.623251 O\n0.250000 0.528822 0.376749 O\n0.057278 0.534800 0.184143 O\n0.442722 0.534800 0.184143 O\n0.250000 0.610730 0.937458 O\n0.750000 0.665293 0.755713 O\n0.555013 0.695037 0.482669 O\n0.944987 0.695037 0.482669 O\n0.750000 0.714920 0.284462 O\n0.250000 0.785080 0.784462 O\n0.055013 0.804963 0.982669 O\n0.444987 0.804963 0.982669 O\n0.250000 0.834707 0.255713 O\n0.750000 0.889270 0.437458 O\n0.557278 0.965200 0.684143 O\n0.942722 0.965200 0.684143 O\n0.750000 0.971178 0.876749 O\n0.250000 0.055016 0.878244 F\n0.750000 0.135523 0.466700 F\n0.250000 0.364477 0.966700 F\n0.750000 0.444984 0.378244 F\n0.250000 0.555016 0.621756 F\n0.750000 0.635523 0.033300 F\n0.250000 0.864477 0.533300 F\n0.750000 0.944984 0.121756 F\n",
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