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{
"id": "mp-1266259",
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"formula_full": "Li40 Fe8 Si16 O64",
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"spacegroup": 62
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{
"id": "mp-1223741",
"created_at": "2022-09-04T14:48:17.280464Z",
"structure_string": "K4 Si8 H4 O20\n1.0\n4.873032 0.000000 0.000000\n0.000000 8.336547 0.000000\n0.000000 0.000000 12.650118\nK Si H O\n4 8 4 20\ndirect\n0.961004 0.250436 0.541500 K\n0.538996 0.250436 0.041500 K\n0.038996 0.750436 0.458500 K\n0.461004 0.750436 0.958500 K\n0.469885 0.564383 0.692705 Si\n0.032508 0.940493 0.183093 Si\n0.530115 0.064383 0.307295 Si\n0.967492 0.440493 0.816907 Si\n0.532508 0.440493 0.316907 Si\n0.969885 0.064383 0.807295 Si\n0.467492 0.940493 0.683093 Si\n0.030115 0.564383 0.192705 Si\n0.025572 0.500962 0.014114 H\n0.974428 0.000962 0.985886 H\n0.525572 0.000962 0.485886 H\n0.474428 0.500962 0.514114 H\n0.069177 0.251984 0.810944 O\n0.430823 0.251984 0.310944 O\n0.930823 0.751984 0.189056 O\n0.569177 0.751984 0.689056 O\n0.245936 0.545870 0.788718 O\n0.253528 0.958955 0.281546 O\n0.754064 0.045870 0.211282 O\n0.746472 0.458955 0.718454 O\n0.753528 0.458955 0.218454 O\n0.745936 0.045870 0.711282 O\n0.246473 0.958955 0.781546 O\n0.254064 0.545870 0.288718 O\n0.335471 0.506840 0.581432 O\n0.154013 0.993077 0.070881 O\n0.664529 0.006840 0.418568 O\n0.845987 0.493077 0.929119 O\n0.654013 0.493077 0.429119 O\n0.835471 0.006840 0.918568 O\n0.345987 0.993077 0.570881 O\n0.164529 0.506840 0.081432 O\n",
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"formula_full": "K4 Si8 H4 O20",
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"spacegroup": 33
},
{
"id": "mp-23778",
"created_at": "2022-09-04T14:48:17.281127Z",
"structure_string": "H8 C2 N4 O2\n1.0\n5.644488 0.000000 0.000000\n0.000000 5.644488 0.000000\n0.000000 0.000000 4.705844\nH C N O\n8 2 4 2\ndirect\n0.857243 0.642757 0.961535 H\n0.357243 0.857243 0.038465 H\n0.642757 0.142757 0.038465 H\n0.142757 0.357243 0.961535 H\n0.256810 0.243190 0.281796 H\n0.243190 0.743190 0.718204 H\n0.756810 0.256810 0.718204 H\n0.743190 0.756810 0.281796 H\n0.500000 0.000000 0.672648 C\n0.000000 0.500000 0.327352 C\n0.355386 0.855386 0.821947 N\n0.144614 0.355386 0.178053 N\n0.644614 0.144614 0.821947 N\n0.855386 0.644614 0.178053 N\n0.000000 0.500000 0.598723 O\n0.500000 0.000000 0.401277 O\n",
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],
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"formula_full": "H8 C2 N4 O2",
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{
"id": "mp-1229085",
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"structure_string": "Ag1 Bi1 Te2\n1.0\n4.388306 0.000000 0.000000\n0.000000 4.388306 0.000000\n0.000000 0.000000 6.297661\nAg Bi Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Bi\n0.000000 0.000000 0.500000 Te\n0.500000 0.500000 0.000000 Te\n",
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{
"id": "mp-1234742",
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"structure_string": "Mg1 Al2 H4 Pb2 O4 F6\n1.0\n7.282251 -0.175067 -2.252633\n-2.383769 6.792517 -0.072249\n-0.256200 -0.056807 5.141540\nMg Al H Pb O F\n1 2 4 2 4 6\ndirect\n0.563186 0.113537 0.150355 Mg\n0.194603 0.688713 0.165266 Al\n0.823492 0.337834 0.833617 Al\n0.158219 0.434864 0.766522 H\n0.870376 0.538108 0.283880 H\n0.135871 0.866062 0.743842 H\n0.929272 0.155383 0.238135 H\n0.750197 0.792725 0.787511 Pb\n0.270778 0.207632 0.329918 Pb\n0.102941 0.446260 0.908921 O\n0.911351 0.557476 0.120871 O\n0.093291 0.854048 0.905322 O\n0.809871 0.132499 0.062393 O\n0.232294 0.864145 0.453229 F\n0.747661 0.135620 0.550774 F\n0.328233 0.572006 0.440928 F\n0.770829 0.493782 0.555460 F\n0.437965 0.819226 0.120642 F\n0.557070 0.277118 0.819915 F\n",
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{
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{
"id": "mp-759292",
"created_at": "2022-09-04T14:48:17.961915Z",
"structure_string": "Li4 Fe6 B6 O18\n1.0\n6.118168 0.000000 0.000000\n0.000000 8.161840 0.000000\n0.000000 4.075556 7.131519\nLi Fe B O\n4 6 6 18\ndirect\n0.000000 0.723994 0.311930 Li\n0.500000 0.989494 0.711838 Li\n0.000000 0.292789 0.978793 Li\n0.500000 0.296592 0.975725 Li\n0.251327 0.640045 0.010910 Fe\n0.748673 0.640045 0.010910 Fe\n0.748539 0.364117 0.617550 Fe\n0.251461 0.364117 0.617550 Fe\n0.248582 0.004621 0.369925 Fe\n0.751418 0.004621 0.369925 Fe\n0.500000 0.326167 0.326987 B\n0.000000 0.334716 0.327705 B\n0.249009 0.000309 0.005912 B\n0.750991 0.000309 0.005912 B\n0.500000 0.665206 0.669873 B\n0.000000 0.666331 0.668608 B\n0.766729 0.900322 0.195247 O\n0.233271 0.900322 0.195247 O\n0.000000 0.537753 0.202758 O\n0.500000 0.524198 0.204764 O\n0.000000 0.855561 0.548088 O\n0.500000 0.858346 0.558842 O\n0.264236 0.900514 0.904911 O\n0.735764 0.900514 0.904911 O\n0.000000 0.541105 0.602761 O\n0.500000 0.537419 0.610134 O\n0.500000 0.210293 0.249226 O\n0.000000 0.220463 0.248658 O\n0.500000 0.255747 0.518684 O\n0.000000 0.270597 0.514900 O\n0.000000 0.592562 0.866738 O\n0.500000 0.592964 0.868663 O\n0.251632 0.195330 0.904141 O\n0.748368 0.195330 0.904141 O\n",
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{
"id": "mp-1208476",
"created_at": "2022-09-04T14:48:17.243478Z",
"structure_string": "Tb16 Cd4 Pd4\n1.0\n0.000000 6.906578 6.906578\n6.906578 0.000000 6.906578\n6.906578 6.906578 0.000000\nTb Cd Pd\n16 4 4\ndirect\n0.353291 0.353291 0.353291 Tb\n0.353291 0.353291 0.940128 Tb\n0.353291 0.940128 0.353291 Tb\n0.940128 0.353291 0.353291 Tb\n0.810681 0.189319 0.189319 Tb\n0.189319 0.810681 0.810681 Tb\n0.189319 0.810681 0.189319 Tb\n0.810681 0.189319 0.810681 Tb\n0.189319 0.189319 0.810681 Tb\n0.810681 0.810681 0.189319 Tb\n0.933904 0.566096 0.566096 Tb\n0.566096 0.933904 0.933904 Tb\n0.566096 0.933904 0.566096 Tb\n0.933904 0.566096 0.933904 Tb\n0.566096 0.566096 0.933904 Tb\n0.933904 0.933904 0.566096 Tb\n0.582027 0.582027 0.582027 Cd\n0.582027 0.582027 0.253918 Cd\n0.582027 0.253918 0.582027 Cd\n0.253918 0.582027 0.582027 Cd\n0.144106 0.144106 0.144106 Pd\n0.144106 0.144106 0.567682 Pd\n0.144106 0.567682 0.144106 Pd\n0.567682 0.144106 0.144106 Pd\n",
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