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{
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{
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{
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"structure_string": "Sr3 Sc1\n1.0\n-2.781317 2.781317 5.786730\n2.781317 -2.781317 5.786730\n2.781317 2.781317 -5.786730\nSr Sc\n3 1\ndirect\n0.750000 0.250000 0.500000 Sr\n0.250000 0.750000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.000000 Sc\n",
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"spacegroup": 139
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{
"id": "mp-25201",
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"structure_string": "Bi2 Pd4 O8\n1.0\n6.891764 0.000000 0.000000\n0.000000 6.891764 0.000000\n0.000000 0.000000 4.561948\nBi Pd O\n2 4 8\ndirect\n0.500000 0.000000 0.510210 Bi\n0.000000 0.500000 0.489790 Bi\n0.250000 0.250000 0.000000 Pd\n0.250000 0.750000 0.000000 Pd\n0.750000 0.250000 0.000000 Pd\n0.750000 0.750000 0.000000 Pd\n0.775652 0.000000 0.774959 O\n0.000000 0.224348 0.225041 O\n0.500000 0.275652 0.774959 O\n0.275652 0.500000 0.225041 O\n0.724348 0.500000 0.225041 O\n0.224348 0.000000 0.774959 O\n0.000000 0.775652 0.225041 O\n0.500000 0.724348 0.774959 O\n",
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{
"id": "mp-631516",
"created_at": "2022-09-04T14:40:26.449549Z",
"structure_string": "Be2 Hg1 Te1\n1.0\n0.000000 3.339434 3.339434\n3.339434 0.000000 3.339434\n3.339434 3.339434 0.000000\nBe Hg Te\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Be\n0.250000 0.250000 0.250000 Be\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Te\n",
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{
"id": "mp-1217144",
"created_at": "2022-09-04T14:40:26.451073Z",
"structure_string": "Ti4 Al1 Ge7\n1.0\n-1.849683 1.849683 14.174752\n1.849683 -1.849683 14.174752\n1.849683 1.849683 -14.174752\nTi Al Ge\n4 1 7\ndirect\n0.825268 0.825268 0.000000 Ti\n0.072930 0.572930 0.500000 Ti\n0.427070 0.927070 0.500000 Ti\n0.174732 0.174732 0.000000 Ti\n0.250000 0.750000 0.500000 Al\n0.658786 0.658786 0.000000 Ge\n0.906366 0.406366 0.500000 Ge\n0.593634 0.093634 0.500000 Ge\n0.341214 0.341214 0.000000 Ge\n0.500000 0.500000 0.000000 Ge\n0.750000 0.250000 0.500000 Ge\n0.000000 0.000000 0.000000 Ge\n",
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{
"id": "mp-706446",
"created_at": "2022-09-04T14:40:26.453821Z",
"structure_string": "Cs2 Ti2 H20 C8 O26\n1.0\n11.945101 0.000000 0.000000\n0.000000 7.228416 0.000000\n0.000000 1.677090 7.838244\nCs Ti H C O\n2 2 20 8 26\ndirect\n0.750000 0.943825 0.740243 Cs\n0.250000 0.056175 0.259757 Cs\n0.250000 0.316495 0.700600 Ti\n0.750000 0.683505 0.299400 Ti\n0.181096 0.678900 0.577032 H\n0.681096 0.321100 0.422968 H\n0.818904 0.321100 0.422968 H\n0.318904 0.678900 0.577032 H\n0.065042 0.877530 0.881749 H\n0.565042 0.122470 0.118251 H\n0.934958 0.122470 0.118251 H\n0.434958 0.877530 0.881749 H\n0.186447 0.547886 0.102886 H\n0.686447 0.452114 0.897114 H\n0.813553 0.452114 0.897114 H\n0.313553 0.547886 0.102886 H\n0.018855 0.836417 0.709630 H\n0.518855 0.163583 0.290370 H\n0.981145 0.163583 0.290370 H\n0.481145 0.836417 0.709630 H\n0.926330 0.621235 0.064116 H\n0.426330 0.378765 0.935884 H\n0.073670 0.378765 0.935884 H\n0.573670 0.621235 0.064116 H\n0.991086 0.324096 0.739898 C\n0.491086 0.675904 0.260102 C\n0.008914 0.675904 0.260102 C\n0.508914 0.324096 0.739898 C\n0.021513 0.275703 0.574184 C\n0.521513 0.724297 0.425816 C\n0.978487 0.724297 0.425816 C\n0.478487 0.275703 0.574184 C\n0.250000 0.619627 0.635463 O\n0.750000 0.380373 0.364537 O\n0.250000 0.129399 0.863206 O\n0.750000 0.870601 0.136794 O\n0.250000 0.475546 0.070236 O\n0.750000 0.524454 0.929764 O\n0.082048 0.398006 0.811129 O\n0.582048 0.601994 0.188871 O\n0.917952 0.601994 0.188871 O\n0.417952 0.398006 0.811129 O\n0.129179 0.279152 0.540620 O\n0.629179 0.720848 0.459380 O\n0.870821 0.720848 0.459380 O\n0.370821 0.279152 0.540620 O\n0.898547 0.301270 0.809747 O\n0.398547 0.698730 0.190253 O\n0.101453 0.698730 0.190253 O\n0.601453 0.301270 0.809747 O\n0.947004 0.225604 0.481052 O\n0.447004 0.774396 0.518948 O\n0.052996 0.774396 0.518948 O\n0.552996 0.225604 0.481052 O\n0.995540 0.860846 0.822378 O\n0.495540 0.139154 0.177622 O\n0.004460 0.139154 0.177622 O\n0.504460 0.860846 0.822378 O\n",
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{
"id": "mp-1198740",
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"structure_string": "Li28 Nd12 Zr8 O48\n1.0\n-6.525442 6.525442 6.307302\n6.525442 -6.525442 6.307302\n6.525442 6.525442 -6.307302\nLi Nd Zr O\n28 12 8 48\ndirect\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Li\n0.250000 0.750000 0.500000 Li\n0.750000 0.250000 0.500000 Li\n0.932731 0.932731 0.365461 Li\n0.067269 0.432731 0.000000 Li\n0.682731 0.182731 0.865461 Li\n0.817269 0.682731 0.500000 Li\n0.317269 0.817269 0.134539 Li\n0.182731 0.317269 0.500000 Li\n0.567269 0.567269 0.634539 Li\n0.432731 0.067269 0.000000 Li\n0.908824 0.149472 0.917717 Li\n0.731755 0.649472 0.240648 Li\n0.899472 0.158824 0.417717 Li\n0.241107 0.658824 0.259352 Li\n0.341176 0.600528 0.582283 Li\n0.518245 0.100528 0.259352 Li\n0.350528 0.591176 0.082283 Li\n0.008893 0.091176 0.240648 Li\n0.408824 0.491107 0.759352 Li\n0.231755 0.991107 0.082283 Li\n0.399472 0.981755 0.740648 Li\n0.741107 0.481755 0.582283 Li\n0.841176 0.258893 0.740648 Li\n0.018245 0.758893 0.417717 Li\n0.850528 0.768245 0.759352 Li\n0.508893 0.268245 0.917717 Li\n0.750000 0.750000 0.000000 Nd\n0.250000 0.250000 0.000000 Nd\n0.500000 0.000000 0.500000 Nd\n0.000000 0.500000 0.500000 Nd\n0.375000 0.752468 0.877468 Nd\n0.375000 0.252468 0.377468 Nd\n0.502468 0.625000 0.377468 Nd\n0.747532 0.125000 0.122532 Nd\n0.875000 0.997532 0.622532 Nd\n0.875000 0.497532 0.122532 Nd\n0.002468 0.625000 0.877468 Nd\n0.247532 0.125000 0.622532 Nd\n0.625000 0.875000 0.750000 Zr\n0.625000 0.375000 0.250000 Zr\n0.625000 0.875000 0.250000 Zr\n0.125000 0.375000 0.250000 Zr\n0.125000 0.375000 0.750000 Zr\n0.125000 0.875000 0.250000 Zr\n0.125000 0.875000 0.750000 Zr\n0.625000 0.375000 0.750000 Zr\n0.528086 0.957314 0.124910 O\n0.332404 0.457314 0.429227 O\n0.707314 0.778086 0.624910 O\n0.653177 0.278086 0.070773 O\n0.721914 0.792686 0.375090 O\n0.917596 0.292686 0.070773 O\n0.542686 0.971914 0.875090 O\n0.596823 0.471914 0.429227 O\n0.028086 0.903177 0.570773 O\n0.832404 0.403177 0.875090 O\n0.207314 0.582404 0.929227 O\n0.153177 0.082404 0.375090 O\n0.221914 0.846823 0.929227 O\n0.417596 0.346823 0.624910 O\n0.042686 0.167596 0.570773 O\n0.096823 0.667596 0.124910 O\n0.813308 0.972924 0.227611 O\n0.245313 0.472924 0.159616 O\n0.722924 0.063308 0.727611 O\n0.835697 0.563308 0.340384 O\n0.436692 0.777076 0.272389 O\n0.004687 0.277076 0.340384 O\n0.527076 0.686692 0.772389 O\n0.414303 0.186692 0.159616 O\n0.313308 0.085697 0.840384 O\n0.745313 0.585697 0.772389 O\n0.222924 0.495313 0.659616 O\n0.335697 0.995313 0.272389 O\n0.936692 0.664303 0.659616 O\n0.504687 0.164303 0.727611 O\n0.027076 0.254687 0.840384 O\n0.914303 0.754687 0.227611 O\n0.534704 0.692273 0.043757 O\n0.148516 0.192273 0.157569 O\n0.442273 0.784704 0.543757 O\n0.740947 0.284704 0.342431 O\n0.715296 0.057727 0.456243 O\n0.101484 0.557727 0.342431 O\n0.807727 0.965296 0.956243 O\n0.509053 0.465296 0.157569 O\n0.034704 0.990947 0.842431 O\n0.648516 0.490947 0.956243 O\n0.942273 0.398516 0.657569 O\n0.240947 0.898516 0.456243 O\n0.215296 0.759053 0.657569 O\n0.601484 0.259053 0.543757 O\n0.307727 0.351484 0.842431 O\n0.009053 0.851484 0.043757 O\n",
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{
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