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{
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"structure_string": "Sr4 Co8 Te12 Cl8 O32\n1.0\n9.177205 0.000000 0.000000\n0.000000 6.706548 0.000000\n0.000000 5.305525 18.728450\nSr Co Te Cl O\n4 8 12 8 32\ndirect\n0.619457 0.514343 0.228044 Sr\n0.880543 0.514343 0.728044 Sr\n0.119457 0.485657 0.271956 Sr\n0.380543 0.485657 0.771956 Sr\n0.456725 0.809713 0.319392 Co\n0.755515 0.062619 0.323777 Co\n0.956725 0.190287 0.180608 Co\n0.744485 0.062619 0.823777 Co\n0.255515 0.937381 0.176223 Co\n0.043275 0.809713 0.819392 Co\n0.244485 0.937381 0.676223 Co\n0.543275 0.190287 0.680608 Co\n0.926689 0.777271 0.111853 Te\n0.573311 0.777271 0.611853 Te\n0.073311 0.222729 0.888147 Te\n0.607739 0.090954 0.137324 Te\n0.107739 0.909046 0.362676 Te\n0.392261 0.909046 0.862676 Te\n0.290013 0.451351 0.105775 Te\n0.426689 0.222729 0.388147 Te\n0.709987 0.548649 0.894225 Te\n0.209987 0.451351 0.605775 Te\n0.790013 0.548649 0.394225 Te\n0.892261 0.090954 0.637324 Te\n0.104078 0.746469 0.947678 Cl\n0.895922 0.253531 0.052322 Cl\n0.395922 0.746469 0.447678 Cl\n0.319254 0.090487 0.047699 Cl\n0.680746 0.909513 0.952301 Cl\n0.604078 0.253531 0.552322 Cl\n0.819254 0.909513 0.452301 Cl\n0.180746 0.090487 0.547699 Cl\n0.738085 0.358289 0.838720 O\n0.428623 0.493663 0.323910 O\n0.232536 0.837066 0.293763 O\n0.016431 0.371896 0.640950 O\n0.261915 0.641711 0.161280 O\n0.730907 0.818274 0.141298 O\n0.230907 0.181726 0.358702 O\n0.309748 0.237219 0.675298 O\n0.267464 0.837066 0.793763 O\n0.979184 0.092665 0.296936 O\n0.928623 0.506337 0.176090 O\n0.769093 0.818274 0.641298 O\n0.761915 0.358289 0.338720 O\n0.269093 0.181726 0.858702 O\n0.520816 0.092665 0.796936 O\n0.190252 0.237219 0.175298 O\n0.522771 0.103510 0.322110 O\n0.809748 0.762781 0.824702 O\n0.238085 0.641711 0.661280 O\n0.516431 0.628104 0.859050 O\n0.071377 0.493663 0.823910 O\n0.483569 0.371896 0.140950 O\n0.977229 0.103510 0.822110 O\n0.020816 0.907335 0.703064 O\n0.983569 0.628104 0.359050 O\n0.732536 0.162934 0.206237 O\n0.022771 0.896490 0.177890 O\n0.690252 0.762781 0.324702 O\n0.477229 0.896490 0.677890 O\n0.767464 0.162934 0.706237 O\n0.479184 0.907335 0.203064 O\n0.571377 0.506337 0.676090 O\n",
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"formula_full": "Sr4 Co8 Te12 Cl8 O32",
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"updated_at": "2021-11-28T01:37:44.822000Z",
"spacegroup": 14
},
{
"id": "mp-38035",
"created_at": "2022-09-04T14:39:35.529326Z",
"structure_string": "Sr2 C2 O6\n1.0\n6.397186 -2.628907 0.000000\n6.397186 2.628907 0.000000\n5.316843 0.000000 4.423383\nSr C O\n2 2 6\ndirect\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.750000 0.750000 0.750000 C\n0.250000 0.250000 0.250000 C\n0.002630 0.497370 0.250000 O\n0.750000 0.997370 0.502630 O\n0.997370 0.502630 0.750000 O\n0.250000 0.002630 0.497370 O\n0.502630 0.750000 0.997370 O\n0.497370 0.250000 0.002630 O\n",
"nsites": 10,
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"density": 3.2953514255281005,
"density_atomic": 0.06721268716712958,
"volume": 148.78143430174455,
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"formula_full": "Sr2 C2 O6",
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"spacegroup": 167
},
{
"id": "mp-1218370",
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"structure_string": "Sr1 C1 O3\n1.0\n3.544344 -2.587395 0.000000\n3.544344 2.587395 0.000000\n1.655528 0.000000 4.064015\nSr C O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 C\n0.748212 0.251788 0.000000 O\n0.000000 0.748212 0.251788 O\n0.251788 0.000000 0.748212 O\n",
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{
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"structure_string": "Sr4 C4 O12\n1.0\n5.163186 0.000000 0.000000\n0.000000 6.136911 0.000000\n0.000000 0.000000 8.511269\nSr C O\n4 4 12\ndirect\n0.250000 0.256126 0.416134 Sr\n0.750000 0.743874 0.583866 Sr\n0.250000 0.756126 0.083866 Sr\n0.750000 0.243874 0.916134 Sr\n0.250000 0.417183 0.758219 C\n0.750000 0.582817 0.241781 C\n0.250000 0.917183 0.741781 C\n0.750000 0.082817 0.258219 C\n0.031955 0.915984 0.818566 O\n0.531955 0.084016 0.181434 O\n0.468045 0.415984 0.681434 O\n0.968045 0.584016 0.318566 O\n0.750000 0.091444 0.410627 O\n0.250000 0.908556 0.589373 O\n0.750000 0.591444 0.089373 O\n0.250000 0.408556 0.910627 O\n0.968045 0.084016 0.181434 O\n0.468045 0.915984 0.818566 O\n0.531955 0.584016 0.318566 O\n0.031955 0.415984 0.681434 O\n",
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"formula_full": "Sr4 C4 O12",
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},
{
"id": "mp-33746",
"created_at": "2022-09-04T14:46:05.469597Z",
"structure_string": "Sr2 C2 O6\n1.0\n2.597204 3.516403 0.000000\n-2.597204 3.516403 0.000000\n0.000000 3.256551 7.710973\nSr C O\n2 2 6\ndirect\n0.500000 0.500000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.965600 0.965600 0.232423 C\n0.034400 0.034400 0.767577 C\n0.902764 0.336153 0.696268 O\n0.874036 0.874036 0.910318 O\n0.336153 0.902764 0.696268 O\n0.663847 0.097236 0.303732 O\n0.097236 0.663847 0.303732 O\n0.125964 0.125964 0.089682 O\n",
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"volume": 140.84579421162286,
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"formula_full": "Sr2 C2 O6",
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"spacegroup": 12
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{
"id": "mp-1196626",
"created_at": "2022-09-04T14:47:55.855360Z",
"structure_string": "Sr2 Co6 P8 O28\n1.0\n7.808517 0.000000 0.000000\n0.000000 7.561409 0.000000\n0.000000 3.596972 8.916459\nSr Co P O\n2 6 8 28\ndirect\n0.500000 0.000000 0.500000 Sr\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.624896 0.313882 0.027587 Co\n0.124896 0.686118 0.472413 Co\n0.375104 0.686118 0.972413 Co\n0.875104 0.313882 0.527587 Co\n0.203964 0.387784 0.306088 P\n0.703964 0.612216 0.193912 P\n0.796036 0.612216 0.693912 P\n0.296036 0.387784 0.806088 P\n0.557700 0.103911 0.798276 P\n0.057700 0.896089 0.701724 P\n0.442300 0.896089 0.201724 P\n0.942300 0.103911 0.298276 P\n0.179858 0.876561 0.584584 O\n0.679858 0.123439 0.915416 O\n0.820142 0.123439 0.415416 O\n0.320142 0.876561 0.084584 O\n0.624051 0.657097 0.612448 O\n0.124051 0.342903 0.887552 O\n0.375949 0.342903 0.387552 O\n0.875949 0.657097 0.112448 O\n0.371625 0.182443 0.822470 O\n0.871625 0.817557 0.677530 O\n0.628375 0.817557 0.177530 O\n0.128375 0.182443 0.322470 O\n0.577669 0.526635 0.113415 O\n0.077669 0.473365 0.386585 O\n0.422331 0.473365 0.886585 O\n0.922331 0.526635 0.613415 O\n0.615311 0.228484 0.635436 O\n0.115311 0.771516 0.864564 O\n0.384689 0.771516 0.364564 O\n0.884689 0.228484 0.135436 O\n0.211566 0.497822 0.135200 O\n0.711566 0.502178 0.364800 O\n0.788434 0.502178 0.864800 O\n0.288434 0.497822 0.635200 O\n0.517719 0.901953 0.806594 O\n0.017719 0.098047 0.693406 O\n0.482281 0.098047 0.193406 O\n0.982281 0.901953 0.306594 O\n",
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"updated_at": "2021-11-28T01:38:10.846000Z",
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{
"id": "mp-18381",
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"structure_string": "Sr2 Co12 O22\n1.0\n2.819595 -4.883683 0.000000\n2.819595 4.883683 0.000000\n0.000000 0.000000 12.817933\nSr Co O\n2 12 22\ndirect\n0.666667 0.333333 0.750000 Sr\n0.333333 0.666667 0.250000 Sr\n0.333333 0.666667 0.750000 Co\n0.666667 0.333333 0.250000 Co\n0.000000 0.000000 0.350916 Co\n0.000000 0.000000 0.850916 Co\n0.000000 0.000000 0.649084 Co\n0.000000 0.000000 0.149084 Co\n0.500000 0.500000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.000000 0.000000 Co\n0.500000 0.000000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n0.666667 0.333333 0.078308 O\n0.333333 0.666667 0.578308 O\n0.333333 0.666667 0.921692 O\n0.666667 0.333333 0.421692 O\n0.856890 0.143110 0.250000 O\n0.713781 0.856890 0.750000 O\n0.143110 0.286219 0.750000 O\n0.856890 0.713781 0.250000 O\n0.286219 0.143110 0.250000 O\n0.143110 0.856890 0.750000 O\n0.175589 0.351178 0.421042 O\n0.648822 0.824411 0.421042 O\n0.175589 0.824411 0.421042 O\n0.824411 0.175589 0.921042 O\n0.175589 0.824411 0.078958 O\n0.351178 0.175589 0.578958 O\n0.824411 0.648822 0.578958 O\n0.175589 0.351178 0.078958 O\n0.648822 0.824411 0.078958 O\n0.351178 0.175589 0.921042 O\n0.824411 0.648822 0.921042 O\n0.824411 0.175589 0.578958 O\n",
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"elements": [
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"density": 5.806730425826467,
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"volume": 353.0060842236233,
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"formula_full": "Sr2 Co12 O22",
"formula_reduced": "SrCo6O11",
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{
"id": "mp-1247416",
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"structure_string": "Sr2 Co14 N20\n1.0\n6.985166 0.000000 -0.065534\n0.000000 7.165091 0.000000\n-2.778850 0.000000 9.257503\nSr Co N\n2 14 20\ndirect\n0.907832 0.013742 0.649801 Sr\n0.907832 0.986258 0.149801 Sr\n0.542378 0.970934 0.832810 Co\n0.542378 0.029066 0.332810 Co\n0.362413 0.031881 0.018700 Co\n0.362413 0.968119 0.518700 Co\n0.100368 0.377815 0.071382 Co\n0.100368 0.622185 0.571382 Co\n0.658122 0.373447 0.991727 Co\n0.658122 0.626553 0.491727 Co\n0.845455 0.632143 0.813990 Co\n0.845455 0.367857 0.313990 Co\n0.286124 0.635248 0.879846 Co\n0.286124 0.364752 0.379846 Co\n0.479419 0.366484 0.686113 Co\n0.479419 0.633516 0.186113 Co\n0.769822 0.852859 0.857582 N\n0.769822 0.147141 0.357582 N\n0.578613 0.138718 0.982487 N\n0.578613 0.861282 0.482487 N\n0.312058 0.877676 0.861224 N\n0.312058 0.122324 0.361224 N\n0.150665 0.158371 0.017152 N\n0.150665 0.841629 0.517152 N\n0.296808 0.520444 0.716988 N\n0.296808 0.479556 0.216988 N\n0.474952 0.110315 0.673694 N\n0.474952 0.889685 0.173694 N\n0.887855 0.379174 0.139105 N\n0.887855 0.620826 0.639105 N\n0.082212 0.559718 0.939710 N\n0.082212 0.440282 0.439710 N\n0.702874 0.429086 0.820870 N\n0.702874 0.570914 0.320870 N\n0.504331 0.559168 0.016119 N\n0.504331 0.440832 0.516119 N\n",
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{
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{
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{
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"created_at": "2022-09-04T14:41:53.230804Z",
"structure_string": "Sr4 Co4 As4 H4 O20\n1.0\n0.000000 0.000000 6.134239\n7.743930 0.000000 0.000000\n0.000000 9.320031 0.000000\nSr Co As H O\n4 4 4 4 20\ndirect\n0.026400 0.365506 0.833605 Sr\n0.526400 0.134494 0.166395 Sr\n0.973600 0.865506 0.666395 Sr\n0.473600 0.634494 0.333605 Sr\n0.257085 0.758372 0.993729 Co\n0.757085 0.741628 0.006271 Co\n0.742915 0.258372 0.506271 Co\n0.242915 0.241628 0.493729 Co\n0.986688 0.382652 0.186250 As\n0.486688 0.117348 0.813750 As\n0.013312 0.882652 0.313750 As\n0.513312 0.617348 0.686250 As\n0.989933 0.001219 0.984824 H\n0.489933 0.498781 0.015176 H\n0.010067 0.501219 0.515176 H\n0.510067 0.998781 0.484824 H\n0.007709 0.559509 0.070125 O\n0.507709 0.940491 0.929875 O\n0.992291 0.059509 0.429875 O\n0.492291 0.440491 0.570125 O\n0.934475 0.212162 0.072523 O\n0.434475 0.287838 0.927477 O\n0.065525 0.712162 0.427477 O\n0.565525 0.787838 0.572523 O\n0.269172 0.640015 0.778214 O\n0.769172 0.859985 0.221786 O\n0.730828 0.140015 0.721786 O\n0.230828 0.359985 0.278214 O\n0.740430 0.607207 0.796537 O\n0.240430 0.892793 0.203463 O\n0.259570 0.107207 0.703463 O\n0.759570 0.392793 0.296537 O\n0.996942 0.890993 0.932631 O\n0.496942 0.609007 0.067369 O\n0.003058 0.390993 0.567369 O\n0.503058 0.109007 0.432631 O\n",
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"formula_full": "Sr4 Co4 As4 H4 O20",
"formula_reduced": "SrCoAsHO5",
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"spacegroup": 19
},
{
"id": "mp-743579",
"created_at": "2022-09-04T14:45:27.115150Z",
"structure_string": "Sr2 Co2 Bi2 Ru2 O12\n1.0\n5.651584 0.000000 0.000000\n0.000000 5.694954 0.000000\n0.000000 5.623930 7.878494\nSr Co Bi Ru O\n2 2 2 2 12\ndirect\n0.273974 0.750625 0.250404 Sr\n0.726026 0.750625 0.750404 Sr\n0.252676 0.496742 0.000490 Co\n0.747324 0.496742 0.500490 Co\n0.788866 0.216192 0.249057 Bi\n0.211134 0.216192 0.749057 Bi\n0.252546 0.000982 0.499589 Ru\n0.747454 0.000982 0.999589 Ru\n0.769239 0.315150 0.756928 O\n0.005781 0.183009 0.051302 O\n0.015418 0.797510 0.450801 O\n0.537861 0.227621 0.049256 O\n0.528868 0.841012 0.450923 O\n0.261655 0.671156 0.741251 O\n0.230761 0.315150 0.256928 O\n0.994219 0.183009 0.551302 O\n0.984582 0.797510 0.950801 O\n0.471132 0.841012 0.950923 O\n0.462139 0.227621 0.549256 O\n0.738345 0.671156 0.241251 O\n",
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"formula_full": "Sr2 Co2 Bi2 Ru2 O12",
"formula_reduced": "SrCoBiRuO6",
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]
}