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{
"id": "mp-769506",
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"formula_full": "Na8 Fe4 P4 C4 O28",
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{
"id": "mp-767341",
"created_at": "2022-09-04T14:41:10.729743Z",
"structure_string": "Li4 Sc2 P2 C2 O14\n1.0\n6.577452 0.000000 0.000000\n0.000000 5.022800 0.000000\n0.000000 0.143005 8.602678\nLi Sc P C O\n4 2 2 2 14\ndirect\n0.997668 0.775192 0.781142 Li\n0.502332 0.775192 0.781142 Li\n0.497668 0.224808 0.218858 Li\n0.002332 0.224808 0.218858 Li\n0.250000 0.224985 0.649670 Sc\n0.750000 0.775015 0.350330 Sc\n0.750000 0.286364 0.579909 P\n0.250000 0.713636 0.420091 P\n0.250000 0.263075 0.947775 C\n0.750000 0.736925 0.052225 C\n0.750000 0.706421 0.905646 O\n0.250000 0.029909 0.882123 O\n0.250000 0.468219 0.848970 O\n0.939673 0.181880 0.665554 O\n0.560327 0.181880 0.665554 O\n0.250000 0.809029 0.593101 O\n0.750000 0.596937 0.572828 O\n0.250000 0.403063 0.427172 O\n0.750000 0.190971 0.406899 O\n0.439673 0.818120 0.334446 O\n0.060327 0.818120 0.334446 O\n0.750000 0.531781 0.151030 O\n0.750000 0.970091 0.117877 O\n0.250000 0.293579 0.094354 O\n",
"nsites": 24,
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"formula_full": "Li4 Sc2 P2 C2 O14",
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},
{
"id": "mp-669354",
"created_at": "2022-09-04T14:41:05.375403Z",
"structure_string": "La1 Nb2 Cu1 Cl1 O7\n1.0\n3.922234 0.000000 0.000000\n0.000000 3.922234 0.000000\n0.000000 0.000000 11.843138\nLa Nb Cu Cl O\n1 2 1 1 7\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.806676 Nb\n0.500000 0.500000 0.193324 Nb\n0.500000 0.500000 0.500000 Cu\n0.000000 0.000000 0.500000 Cl\n0.000000 0.500000 0.156004 O\n0.500000 0.500000 0.654400 O\n0.000000 0.500000 0.843996 O\n0.500000 0.500000 0.345600 O\n0.500000 0.000000 0.156004 O\n0.500000 0.000000 0.843996 O\n0.500000 0.500000 0.000000 O\n",
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"density": 4.8825591944138225,
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"volume": 182.1938822205013,
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"formula_full": "La1 Nb2 Cu1 Cl1 O7",
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{
"id": "mp-1218748",
"created_at": "2022-09-04T14:41:10.646111Z",
"structure_string": "Sr4 La2 Mn2 Co2 O14\n1.0\n-3.881398 -3.909293 -0.001482\n-1.941435 1.959196 10.138822\n-3.882665 3.910627 0.001578\nSr La Mn Co O\n4 2 2 2 14\ndirect\n0.999917 0.005251 0.497577 Sr\n0.499875 0.005549 0.997373 Sr\n0.000007 0.363481 0.318214 Sr\n0.500062 0.364454 0.817722 Sr\n0.499867 0.637238 0.180997 La\n0.000259 0.636603 0.681727 La\n0.499901 0.198542 0.400838 Mn\n0.000169 0.196335 0.902022 Mn\n0.000026 0.811344 0.094265 Co\n0.500093 0.814709 0.592522 Co\n0.000153 0.601364 0.199211 O\n0.499959 0.605957 0.697057 O\n0.500034 0.396019 0.301861 O\n0.000032 0.394745 0.802625 O\n0.499684 0.999702 0.500574 O\n0.999793 0.008338 0.996099 O\n0.755584 0.797506 0.855782 O\n0.244933 0.797468 0.346147 O\n0.745670 0.794829 0.356845 O\n0.254110 0.795378 0.847868 O\n0.748868 0.194046 0.652494 O\n0.251084 0.194047 0.153556 O\n0.748614 0.193519 0.154028 O\n0.251303 0.193579 0.652598 O\n",
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],
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"formula_full": "Sr4 La2 Mn2 Co2 O14",
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{
"id": "mp-25398",
"created_at": "2022-09-04T14:40:18.868236Z",
"structure_string": "Li4 P2 W2 C2 O14\n1.0\n6.689686 0.000000 0.000000\n0.000000 4.998248 0.000000\n0.000000 0.828187 8.775623\nLi P W C O\n4 2 2 2 14\ndirect\n0.980187 0.257352 0.778521 Li\n0.019813 0.742648 0.221479 Li\n0.480187 0.742648 0.221479 Li\n0.519813 0.257352 0.778521 Li\n0.250000 0.230123 0.407640 P\n0.750000 0.769877 0.592360 P\n0.750000 0.290162 0.343903 W\n0.250000 0.709838 0.656097 W\n0.750000 0.209721 0.055084 C\n0.250000 0.790279 0.944916 C\n0.934427 0.656230 0.681933 O\n0.750000 0.447956 0.105772 O\n0.250000 0.992928 0.834650 O\n0.750000 0.007072 0.165350 O\n0.565573 0.656230 0.681933 O\n0.750000 0.681342 0.427858 O\n0.250000 0.552044 0.894228 O\n0.434427 0.343770 0.318067 O\n0.065573 0.343770 0.318067 O\n0.250000 0.916064 0.422145 O\n0.750000 0.171790 0.915248 O\n0.250000 0.828210 0.084752 O\n0.750000 0.083936 0.577855 O\n0.250000 0.318658 0.572142 O\n",
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"formula_full": "Li4 P2 W2 C2 O14",
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{
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"created_at": "2022-09-04T14:40:22.692884Z",
"structure_string": "Na2 Li2 Zn2 P4 O14\n1.0\n3.785862 -6.301707 0.000000\n3.785862 6.301707 0.000000\n0.000000 0.000000 6.434726\nNa Li Zn P O\n2 2 2 4 14\ndirect\n0.241102 0.241102 0.500000 Na\n0.758898 0.758898 0.000000 Na\n0.785791 0.214209 0.750000 Li\n0.214209 0.785791 0.250000 Li\n0.216674 0.783326 0.750000 Zn\n0.783326 0.216674 0.250000 Zn\n0.806822 0.576568 0.496386 P\n0.576568 0.806822 0.503614 P\n0.423432 0.193178 0.003614 P\n0.193178 0.423432 0.996386 P\n0.917752 0.679192 0.700714 O\n0.677869 0.919500 0.701461 O\n0.587637 0.587637 0.500000 O\n0.732860 0.341727 0.501698 O\n0.341727 0.732860 0.498302 O\n0.919500 0.677869 0.298539 O\n0.679192 0.917752 0.299286 O\n0.322131 0.080500 0.201461 O\n0.082248 0.320808 0.200714 O\n0.658273 0.267140 0.998302 O\n0.412363 0.412363 0.000000 O\n0.267140 0.658273 0.001698 O\n0.320808 0.082248 0.799286 O\n0.080500 0.322131 0.798539 O\n",
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"formula_full": "Na2 Li2 Zn2 P4 O14",
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{
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"structure_string": "Na4 Ti2 P2 C2 O14\n1.0\n6.557420 0.000000 0.000000\n0.000000 5.290112 0.000000\n0.000000 0.045666 9.063831\nNa Ti P C O\n4 2 2 2 14\ndirect\n0.998317 0.764088 0.768944 Na\n0.501683 0.764088 0.768944 Na\n0.498317 0.235912 0.231056 Na\n0.001683 0.235912 0.231056 Na\n0.250000 0.219740 0.652156 Ti\n0.750000 0.780260 0.347844 Ti\n0.750000 0.292171 0.574306 P\n0.250000 0.707829 0.425694 P\n0.250000 0.271706 0.927498 C\n0.750000 0.728294 0.072502 C\n0.750000 0.709273 0.935217 O\n0.250000 0.052119 0.857846 O\n0.250000 0.467224 0.835158 O\n0.942924 0.212173 0.662705 O\n0.557076 0.212173 0.662705 O\n0.250000 0.843129 0.577390 O\n0.750000 0.585234 0.553547 O\n0.250000 0.414766 0.446453 O\n0.750000 0.156871 0.422610 O\n0.442924 0.787827 0.337295 O\n0.057076 0.787827 0.337295 O\n0.750000 0.532776 0.164842 O\n0.750000 0.947881 0.142154 O\n0.250000 0.290727 0.064783 O\n",
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"formula_full": "Na4 Ti2 P2 C2 O14",
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{
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"created_at": "2022-09-04T14:46:08.308799Z",
"structure_string": "Li4 Sn2 C2 S2 O14\n1.0\n6.828448 0.000000 0.000000\n0.000000 5.109792 0.000000\n0.000000 0.038953 9.526902\nLi Sn C S O\n4 2 2 2 14\ndirect\n0.526353 0.780801 0.818669 Li\n0.973647 0.780801 0.818669 Li\n0.473647 0.219199 0.181331 Li\n0.026353 0.219199 0.181331 Li\n0.250000 0.233504 0.626211 Sn\n0.750000 0.766496 0.373789 Sn\n0.250000 0.232155 0.914024 C\n0.750000 0.767845 0.085976 C\n0.750000 0.231775 0.636577 S\n0.250000 0.768225 0.363423 S\n0.750000 0.773898 0.952703 O\n0.250000 0.013527 0.839553 O\n0.250000 0.451944 0.841768 O\n0.925524 0.085118 0.690062 O\n0.574476 0.085118 0.690062 O\n0.250000 0.772960 0.520630 O\n0.750000 0.502844 0.687901 O\n0.250000 0.497156 0.312099 O\n0.750000 0.227040 0.479370 O\n0.425524 0.914882 0.309938 O\n0.074476 0.914882 0.309938 O\n0.750000 0.548056 0.158232 O\n0.750000 0.986473 0.160447 O\n0.250000 0.226102 0.047297 O\n",
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{
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"structure_string": "Na4 Si2 Sb2 C2 O14\n1.0\n6.762955 0.000000 0.000000\n0.000000 5.329303 0.000000\n0.000000 0.260421 9.301281\nNa Si Sb C O\n4 2 2 2 14\ndirect\n0.492322 0.236483 0.772272 Na\n0.007678 0.236483 0.772272 Na\n0.507678 0.763517 0.227728 Na\n0.992322 0.763517 0.227728 Na\n0.250000 0.711046 0.578384 Si\n0.750000 0.288954 0.421616 Si\n0.750000 0.781869 0.641846 Sb\n0.250000 0.218131 0.358154 Sb\n0.750000 0.726621 0.930657 C\n0.250000 0.273379 0.069343 C\n0.250000 0.286317 0.935298 O\n0.750000 0.943897 0.856097 O\n0.750000 0.526846 0.849066 O\n0.057213 0.807809 0.669303 O\n0.442787 0.807809 0.669303 O\n0.750000 0.162765 0.587440 O\n0.250000 0.401196 0.568834 O\n0.750000 0.598804 0.431166 O\n0.250000 0.837235 0.412560 O\n0.557213 0.192191 0.330697 O\n0.942787 0.192191 0.330697 O\n0.250000 0.473154 0.150934 O\n0.250000 0.056103 0.143903 O\n0.750000 0.713683 0.064702 O\n",
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