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{
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{
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{
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"structure_string": "K1 Nd1 S2\n1.0\n7.470369 -2.105838 0.000000\n7.470369 2.105838 0.000000\n6.876750 0.000000 3.598789\nK Nd S\n1 1 2\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Nd\n0.735505 0.735505 0.735505 S\n0.264495 0.264495 0.264495 S\n",
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{
"id": "mp-1006886",
"created_at": "2022-09-04T14:40:58.259648Z",
"structure_string": "Ce1 S1\n1.0\n3.512501 0.000000 0.000000\n0.000000 3.512501 0.000000\n0.000000 0.000000 3.512501\nCe S\n1 1\ndirect\n0.000000 0.000000 0.000000 Ce\n0.500000 0.500000 0.500000 S\n",
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{
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"density": 7.216164152184209,
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{
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"structure_string": "K1 Y1 S2\n1.0\n7.498603 -2.026320 0.000000\n7.498603 2.026320 0.000000\n6.951038 0.000000 3.466712\nK Y S\n1 1 2\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Y\n0.733829 0.733829 0.733829 S\n0.266171 0.266171 0.266171 S\n",
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{
"id": "mp-1006891",
"created_at": "2022-09-04T14:43:08.359798Z",
"structure_string": "K1 Sm1 Se2\n1.0\n7.773198 -2.153935 0.000000\n7.773198 2.153935 0.000000\n7.176347 0.000000 3.682673\nK Sm Se\n1 1 2\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Sm\n0.763549 0.763549 0.763549 Se\n0.236451 0.236451 0.236451 Se\n",
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{
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"created_at": "2022-09-04T14:44:02.552621Z",
"structure_string": "Ce1 P12 Ru4\n1.0\n-4.045453 4.045453 4.045453\n4.045453 -4.045453 4.045453\n4.045453 4.045453 -4.045453\nCe P Ru\n1 12 4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.856321 0.644025 0.500346 P\n0.856321 0.355975 0.212296 P\n0.143679 0.644025 0.787704 P\n0.355975 0.499654 0.143679 P\n0.499654 0.143679 0.355975 P\n0.143679 0.355975 0.499654 P\n0.644025 0.787704 0.143679 P\n0.212296 0.856321 0.355975 P\n0.644025 0.500346 0.856321 P\n0.787704 0.143679 0.644025 P\n0.355975 0.212296 0.856321 P\n0.500346 0.856321 0.644025 P\n0.000000 0.000000 0.500000 Ru\n0.000000 0.500000 0.000000 Ru\n0.500000 0.000000 0.000000 Ru\n0.500000 0.500000 0.500000 Ru\n",
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{
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{
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"structure_string": "Ba4 Ag4 P12 O36\n1.0\n6.072151 0.000000 0.000000\n0.000000 11.309948 0.000000\n0.000000 0.000000 12.471077\nBa Ag P O\n4 4 12 36\ndirect\n0.097612 0.108750 0.080768 Ba\n0.597612 0.391250 0.919232 Ba\n0.902388 0.608750 0.419232 Ba\n0.402388 0.891250 0.580768 Ba\n0.103113 0.483329 0.133580 Ag\n0.603113 0.016671 0.866420 Ag\n0.896887 0.983329 0.366420 Ag\n0.396887 0.516671 0.633580 Ag\n0.110475 0.847100 0.856291 P\n0.610475 0.652900 0.143709 P\n0.889525 0.347100 0.643709 P\n0.389525 0.152900 0.356291 P\n0.913490 0.707283 0.685646 P\n0.413490 0.792717 0.314354 P\n0.086510 0.207283 0.814354 P\n0.586510 0.292717 0.185646 P\n0.108666 0.587538 0.868306 P\n0.608666 0.912462 0.131694 P\n0.891334 0.087538 0.631694 P\n0.391334 0.412462 0.368306 P\n0.013579 0.935468 0.931694 O\n0.513579 0.564532 0.068306 O\n0.986421 0.435468 0.568306 O\n0.486421 0.064532 0.431694 O\n0.325935 0.870384 0.800823 O\n0.825935 0.629616 0.199177 O\n0.674065 0.370384 0.699177 O\n0.174065 0.129616 0.300823 O\n0.694184 0.704015 0.630284 O\n0.194184 0.795985 0.369716 O\n0.305816 0.204015 0.869716 O\n0.805816 0.295985 0.130284 O\n0.113325 0.703715 0.613118 O\n0.613325 0.796285 0.386882 O\n0.886675 0.203715 0.886882 O\n0.386675 0.296285 0.113118 O\n0.327269 0.552894 0.821143 O\n0.827269 0.947106 0.178857 O\n0.672731 0.052894 0.678857 O\n0.172731 0.447106 0.321143 O\n0.383737 0.280472 0.417517 O\n0.883737 0.219528 0.582483 O\n0.616263 0.780472 0.082483 O\n0.116263 0.719528 0.917517 O\n0.576844 0.178227 0.263360 O\n0.076844 0.321773 0.736640 O\n0.423156 0.678227 0.236640 O\n0.923156 0.821773 0.763360 O\n0.575028 0.398636 0.273252 O\n0.075028 0.101364 0.726748 O\n0.424972 0.898636 0.226748 O\n0.924972 0.601364 0.773252 O\n0.494850 0.494254 0.449177 O\n0.994850 0.005746 0.550823 O\n0.505150 0.994254 0.050823 O\n0.005150 0.505746 0.949177 O\n",
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{
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"structure_string": "Ge2 Se4\n1.0\n-3.035317 3.035317 4.825271\n3.035317 -3.035317 4.825271\n3.035317 3.035317 -4.825271\nGe Se\n2 4\ndirect\n0.000000 0.000000 0.000000 Ge\n0.750000 0.250000 0.500000 Ge\n0.375000 0.358921 0.483921 Se\n0.641079 0.125000 0.016079 Se\n0.108921 0.625000 0.983921 Se\n0.875000 0.891079 0.516079 Se\n",
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}