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{
"id": "mp-764741",
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{
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"structure_string": "Ba4 Fe12 Si16 S4 O44\n1.0\n5.349807 0.000000 0.000000\n0.000000 9.306483 0.000000\n0.000000 0.000000 20.025520\nBa Fe Si S O\n4 12 16 4 44\ndirect\n0.667996 0.000000 0.248811 Ba\n0.332004 0.000000 0.751189 Ba\n0.832004 0.500000 0.748811 Ba\n0.167996 0.500000 0.251189 Ba\n0.000000 0.334285 0.500000 Fe\n0.000000 0.665715 0.500000 Fe\n0.500000 0.165715 0.000000 Fe\n0.500000 0.834285 0.000000 Fe\n0.000000 0.350486 0.000000 Fe\n0.000000 0.649514 0.000000 Fe\n0.500000 0.149514 0.500000 Fe\n0.500000 0.850486 0.500000 Fe\n0.000000 0.000000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.167779 0.166573 0.138321 Si\n0.832221 0.833427 0.861679 Si\n0.832221 0.166573 0.861679 Si\n0.332221 0.333427 0.638321 Si\n0.167779 0.833427 0.138321 Si\n0.667779 0.666573 0.361679 Si\n0.667779 0.333427 0.361679 Si\n0.332221 0.666573 0.638321 Si\n0.168246 0.167878 0.360876 Si\n0.831754 0.832122 0.639124 Si\n0.831754 0.167878 0.639124 Si\n0.331754 0.332122 0.860876 Si\n0.168246 0.832122 0.360876 Si\n0.668246 0.667878 0.139124 Si\n0.668246 0.332122 0.139124 Si\n0.331754 0.667878 0.860876 Si\n0.664494 0.000000 0.086877 S\n0.335506 0.000000 0.913123 S\n0.835506 0.500000 0.586877 S\n0.164494 0.500000 0.413123 S\n0.168189 0.000000 0.173698 O\n0.831811 0.000000 0.826302 O\n0.331811 0.500000 0.673698 O\n0.668189 0.500000 0.326302 O\n0.160534 0.170920 0.058677 O\n0.839466 0.829080 0.941323 O\n0.839466 0.170920 0.941323 O\n0.339466 0.329080 0.558677 O\n0.160534 0.829080 0.058677 O\n0.660534 0.670920 0.441323 O\n0.660534 0.329080 0.441323 O\n0.339466 0.670920 0.558677 O\n0.413506 0.254113 0.173708 O\n0.586494 0.745887 0.826292 O\n0.586494 0.254113 0.826292 O\n0.086494 0.245887 0.673708 O\n0.413506 0.745887 0.173708 O\n0.913506 0.754113 0.326292 O\n0.913506 0.245887 0.326292 O\n0.086494 0.754113 0.673708 O\n0.165965 0.171371 0.439973 O\n0.834035 0.828629 0.560027 O\n0.834035 0.171371 0.560027 O\n0.334035 0.328629 0.939973 O\n0.165965 0.828629 0.439973 O\n0.665965 0.671371 0.060027 O\n0.665965 0.328629 0.060027 O\n0.334035 0.671371 0.939973 O\n0.170343 0.000000 0.328265 O\n0.829657 0.000000 0.671735 O\n0.329657 0.500000 0.828265 O\n0.670343 0.500000 0.171735 O\n0.315777 0.000000 0.556682 O\n0.684223 0.000000 0.443318 O\n0.184223 0.500000 0.056682 O\n0.815777 0.500000 0.943318 O\n0.423474 0.245057 0.326040 O\n0.576526 0.754943 0.673960 O\n0.576526 0.245057 0.673960 O\n0.076526 0.254943 0.826040 O\n0.423474 0.754943 0.326040 O\n0.923474 0.745057 0.173960 O\n0.923474 0.254943 0.173960 O\n0.076526 0.745057 0.826040 O\n",
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{
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"created_at": "2022-09-04T14:42:59.698418Z",
"structure_string": "Ba4 Tb8 Dy4 O24\n1.0\n8.586418 0.000000 0.000000\n0.000000 8.586418 0.000000\n0.000000 0.000000 8.838522\nBa Tb Dy O\n4 8 4 24\ndirect\n0.500000 0.000000 0.500000 Ba\n-0.000000 0.500000 0.000000 Ba\n0.500000 0.500000 0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.756223 0.756223 0.750000 Tb\n0.243777 0.756223 0.750000 Tb\n0.756223 0.756223 0.250000 Tb\n0.243777 0.756223 0.250000 Tb\n0.756223 0.243777 0.750000 Tb\n0.243777 0.243777 0.750000 Tb\n0.756223 0.243777 0.250000 Tb\n0.243777 0.243777 0.250000 Tb\n-0.000000 0.000000 0.000000 Dy\n0.500000 0.000000 0.000000 Dy\n-0.000000 0.000000 0.500000 Dy\n-0.000000 0.500000 0.500000 Dy\n-0.000000 0.793820 0.838210 O\n0.500000 0.764270 0.710023 O\n-0.000000 0.793820 0.161790 O\n0.500000 0.764270 0.289977 O\n-0.000000 0.206180 0.838210 O\n0.500000 0.235730 0.710023 O\n-0.000000 0.206180 0.161790 O\n0.500000 0.235730 0.289977 O\n0.793820 0.000000 0.661790 O\n0.206180 0.000000 0.661790 O\n0.793820 0.000000 0.338210 O\n0.206180 0.000000 0.338210 O\n0.764270 0.500000 0.789977 O\n0.235730 0.500000 0.789977 O\n0.764270 0.500000 0.210023 O\n0.235730 0.500000 0.210023 O\n0.695523 0.825490 0.000000 O\n0.304477 0.825490 0.000000 O\n0.825490 0.695523 0.500000 O\n0.174510 0.695523 0.500000 O\n0.695523 0.174510 0.000000 O\n0.304477 0.174510 0.000000 O\n0.825490 0.304477 0.500000 O\n0.174510 0.304477 0.500000 O\n",
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{
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"structure_string": "Zr2 Ti4\n1.0\n0.000000 3.913738 3.913738\n3.913738 0.000000 3.913738\n3.913738 3.913738 0.000000\nZr Ti\n2 4\ndirect\n0.250000 0.250000 0.250000 Zr\n0.000000 0.000000 0.000000 Zr\n0.625000 0.625000 0.125000 Ti\n0.625000 0.125000 0.625000 Ti\n0.125000 0.625000 0.625000 Ti\n0.625000 0.625000 0.625000 Ti\n",
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{
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{
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}