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{
"id": "mp-1208672",
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"structure_string": "Sr4 Co4 Ge8 O24\n1.0\n-5.007348 4.685446 1.416790\n-4.994934 -4.687962 -4.153013\n-5.023640 -4.687886 6.986565\nSr Co Ge O\n4 4 8 24\ndirect\n0.195423 0.277658 0.527558 Sr\n0.194966 0.777081 0.027990 Sr\n0.805170 0.722884 0.472038 Sr\n0.804632 0.222428 0.972155 Sr\n0.592282 0.578573 0.828105 Co\n0.407504 0.921503 0.672005 Co\n0.590740 0.079245 0.328777 Co\n0.409353 0.420771 0.171150 Co\n0.122754 0.052338 0.262411 Ge\n0.122762 0.552788 0.763003 Ge\n0.877316 0.947136 0.736996 Ge\n0.877138 0.447643 0.237585 Ge\n0.684728 0.294014 0.583465 Ge\n0.683909 0.793594 0.083802 Ge\n0.316142 0.706530 0.416132 Ge\n0.315371 0.205885 0.916530 Ge\n0.875633 0.408553 0.427837 O\n0.874553 0.908349 0.927347 O\n0.125546 0.591721 0.572613 O\n0.124230 0.091439 0.072137 O\n0.164540 0.821786 0.302579 O\n0.164080 0.321855 0.802984 O\n0.836107 0.178040 0.696997 O\n0.835346 0.678244 0.197378 O\n0.310053 0.173743 0.302667 O\n0.309207 0.673244 0.804964 O\n0.690684 0.826730 0.695165 O\n0.689551 0.326263 0.197612 O\n0.522941 0.161089 0.529738 O\n0.522127 0.659453 0.030526 O\n0.478093 0.840626 0.469290 O\n0.477177 0.338752 0.970328 O\n0.884419 0.045489 0.356572 O\n0.883613 0.545744 0.856934 O\n0.116512 0.954287 0.643052 O\n0.115480 0.454554 0.143599 O\n0.596532 0.963979 0.151763 O\n0.597086 0.463493 0.652850 O\n0.403082 0.036298 0.847352 O\n0.403219 0.536199 0.348013 O\n",
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{
"id": "mp-18793",
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"structure_string": "Li4 Cr4 O8\n1.0\n2.823626 -0.002612 4.325178\n-4.379593 2.526471 0.848675\n-2.573372 -5.024300 1.677027\nLi Cr O\n4 4 8\ndirect\n0.000000 0.500000 0.749867 Li\n0.000000 0.499999 0.249883 Li\n0.000000 0.000001 0.500133 Li\n0.000000 0.000001 0.000117 Li\n0.499999 0.999999 0.751924 Cr\n0.500002 0.500001 0.498074 Cr\n0.499998 0.999999 0.251891 Cr\n0.500001 0.500000 0.998108 Cr\n0.726903 0.742791 0.748703 O\n0.726916 0.742799 0.248698 O\n0.726901 0.242790 0.501295 O\n0.726914 0.242797 0.001299 O\n0.273099 0.257211 0.748705 O\n0.273085 0.257202 0.248701 O\n0.273097 0.757209 0.501298 O\n0.273084 0.757201 0.001302 O\n",
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{
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"structure_string": "Ce4 Cd2 Pt4\n1.0\n7.869637 0.000000 0.000000\n0.000000 7.869637 0.000000\n0.000000 0.000000 3.757962\nCe Cd Pt\n4 2 4\ndirect\n0.169618 0.330382 0.500000 Ce\n0.330382 0.830382 0.500000 Ce\n0.830382 0.669618 0.500000 Ce\n0.669618 0.169618 0.500000 Ce\n0.500000 0.500000 0.000000 Cd\n0.000000 0.000000 0.000000 Cd\n0.632349 0.867651 0.000000 Pt\n0.132349 0.632349 0.000000 Pt\n0.867651 0.367651 0.000000 Pt\n0.367651 0.132349 0.000000 Pt\n",
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{
"id": "mp-1181058",
"created_at": "2022-09-04T14:40:12.853184Z",
"structure_string": "Ir2 Pt1 N10 Cl10\n1.0\n4.177612 6.102222 0.000000\n-4.177612 6.102222 0.000000\n0.000000 2.999021 10.776973\nIr Pt N Cl\n2 1 10 10\ndirect\n0.171364 0.171364 0.235344 Ir\n0.828636 0.828636 0.764656 Ir\n0.500000 0.500000 0.500000 Pt\n0.998320 0.306604 0.070566 N\n0.306604 0.998320 0.070566 N\n0.001680 0.693396 0.929434 N\n0.693396 0.001680 0.929434 N\n0.036355 0.379817 0.313640 N\n0.379817 0.036355 0.313640 N\n0.963645 0.620183 0.686360 N\n0.620183 0.963645 0.686360 N\n0.017709 0.017709 0.288669 N\n0.982291 0.982291 0.711331 N\n0.578065 0.578065 0.284487 Cl\n0.421935 0.421935 0.715513 Cl\n0.684186 0.684186 0.526009 Cl\n0.315814 0.315814 0.473991 Cl\n0.779207 0.220793 0.500000 Cl\n0.220793 0.779207 0.500000 Cl\n0.853406 0.853406 0.003076 Cl\n0.146594 0.146594 0.996924 Cl\n0.369026 0.369026 0.110779 Cl\n0.630974 0.630974 0.889221 Cl\n",
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"formula_full": "Ir2 Pt1 N10 Cl10",
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{
"id": "mp-1078638",
"created_at": "2022-09-04T14:40:12.858396Z",
"structure_string": "Ca8\n1.0\n4.561378 0.000000 0.000000\n0.000000 4.561378 0.000000\n0.000000 0.000000 16.031352\nCa\n8\ndirect\n0.007130 0.483393 0.687587 Ca\n0.992870 0.516607 0.187587 Ca\n0.983393 0.492870 0.437587 Ca\n0.016607 0.507130 0.937587 Ca\n0.516607 0.992870 0.812413 Ca\n0.483393 0.007130 0.312413 Ca\n0.492870 0.983393 0.562413 Ca\n0.507130 0.016607 0.062413 Ca\n",
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"formula_full": "Ca8",
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},
{
"id": "mp-1041848",
"created_at": "2022-09-04T14:40:12.913509Z",
"structure_string": "Mg2 V4 O8\n1.0\n-3.030340 5.250299 0.004761\n3.021784 1.749667 4.936998\n6.034812 -0.015057 0.010773\nMg V O\n2 4 8\ndirect\n0.625007 0.624989 0.750006 Mg\n0.124999 0.624991 0.750005 Mg\n0.624987 0.625044 0.249955 V\n0.994713 0.004370 0.990064 V\n0.255285 0.245638 0.509934 V\n0.624995 0.124991 0.250010 V\n0.388570 0.372575 0.776900 O\n0.387569 0.850379 0.774867 O\n0.862427 0.399621 0.725125 O\n0.861437 0.877412 0.723113 O\n0.856918 0.379335 0.242926 O\n0.384893 0.379063 0.242774 O\n0.865114 0.870932 0.257235 O\n0.393084 0.870660 0.257085 O\n",
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"density": 4.050857237254757,
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"volume": 155.92285790786545,
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"formula_full": "Mg2 V4 O8",
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"energy": -116.31999924,
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{
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"structure_string": "Th1 Sb1 Rh1\n1.0\n0.000000 3.364592 3.364592\n3.364592 0.000000 3.364592\n3.364592 3.364592 0.000000\nTh Sb Rh\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Th\n0.500000 0.500000 0.500000 Sb\n0.750000 0.750000 0.750000 Rh\n",
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{
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"structure_string": "Ti1 P6 W3 O24\n1.0\n7.771264 -4.389788 0.000000\n7.771264 4.389788 0.000000\n5.291586 0.000000 7.187621\nTi P W O\n1 6 3 24\ndirect\n0.858954 0.858954 0.858954 Ti\n0.469334 0.750628 0.034266 P\n0.750628 0.034266 0.469334 P\n0.034266 0.469334 0.750628 P\n0.962696 0.541024 0.245992 P\n0.245992 0.962696 0.541024 P\n0.541024 0.245992 0.962696 P\n0.142469 0.142469 0.142469 W\n0.357695 0.357695 0.357695 W\n0.642706 0.642706 0.642706 W\n0.511722 0.278837 0.129226 O\n0.129226 0.511722 0.278837 O\n0.288877 0.921461 0.060036 O\n0.278837 0.129226 0.511722 O\n0.440733 0.582589 0.209877 O\n0.638597 0.781766 0.999364 O\n0.921461 0.060036 0.288877 O\n0.582589 0.209877 0.440733 O\n0.209877 0.440733 0.582589 O\n0.990229 0.368059 0.220067 O\n0.935577 0.713941 0.075473 O\n0.220067 0.990229 0.368059 O\n0.781766 0.999364 0.638597 O\n0.060036 0.288877 0.921461 O\n0.999364 0.638597 0.781766 O\n0.786421 0.564223 0.419768 O\n0.419768 0.786421 0.564223 O\n0.075473 0.935577 0.713941 O\n0.368059 0.220067 0.990229 O\n0.564223 0.419768 0.786421 O\n0.719917 0.866374 0.491103 O\n0.713941 0.075473 0.935577 O\n0.866374 0.491103 0.719917 O\n0.491103 0.719917 0.866374 O\n",
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{
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"structure_string": "Ti1 V1 As2\n1.0\n1.760819 -3.049828 0.000000\n1.760819 3.049828 0.000000\n0.000000 0.000000 6.257192\nTi V As\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.000000 0.500000 V\n0.333333 0.666667 0.257473 As\n0.666667 0.333333 0.742527 As\n",
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{
"id": "mp-555025",
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"structure_string": "Mo4 P8 Pb4 O32\n1.0\n7.261959 7.208372 0.000000\n-7.261959 7.208372 0.000000\n0.000000 1.365887 6.527023\nMo P Pb O\n4 8 4 32\ndirect\n0.275300 0.991566 0.686575 Mo\n0.991566 0.275300 0.186575 Mo\n0.724700 0.008434 0.313425 Mo\n0.008434 0.724700 0.813425 Mo\n0.984114 0.792132 0.302526 P\n0.493637 0.762947 0.536439 P\n0.506363 0.237053 0.463561 P\n0.207868 0.015886 0.197474 P\n0.237053 0.506363 0.963561 P\n0.762947 0.493637 0.036439 P\n0.015886 0.207868 0.697474 P\n0.792132 0.984114 0.802526 P\n0.490610 0.261899 0.957955 Pb\n0.738101 0.509390 0.542045 Pb\n0.261899 0.490610 0.457955 Pb\n0.509390 0.738101 0.042045 Pb\n0.155340 0.156511 0.669769 O\n0.868053 0.131947 0.250000 O\n0.844660 0.843489 0.330231 O\n0.156511 0.155340 0.169769 O\n0.291929 0.983180 0.002216 O\n0.582756 0.673521 0.662769 O\n0.417244 0.326479 0.337231 O\n0.673521 0.582756 0.162769 O\n0.011229 0.711178 0.127161 O\n0.326479 0.417244 0.837231 O\n0.288822 0.988771 0.372839 O\n0.133475 0.426546 0.133557 O\n0.078429 0.921571 0.250000 O\n0.131947 0.868053 0.750000 O\n0.162690 0.591659 0.804925 O\n0.589234 0.318150 0.582353 O\n0.866525 0.573454 0.866443 O\n0.318150 0.589234 0.082353 O\n0.708071 0.016820 0.997784 O\n0.410766 0.681850 0.417647 O\n0.016820 0.708071 0.497784 O\n0.573454 0.866525 0.366443 O\n0.408341 0.837310 0.695075 O\n0.843489 0.844660 0.830231 O\n0.837310 0.408341 0.195075 O\n0.591659 0.162690 0.304925 O\n0.921571 0.078429 0.750000 O\n0.988771 0.288822 0.872839 O\n0.426546 0.133475 0.633557 O\n0.983180 0.291929 0.502216 O\n0.681850 0.410766 0.917647 O\n0.711178 0.011229 0.627161 O\n",
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}