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{
"id": "mp-753908",
"created_at": "2022-09-04T14:40:14.810457Z",
"structure_string": "Li4 Mn8 O12 F4\n1.0\n5.964382 0.000000 0.000000\n0.000000 5.360590 0.000000\n0.000000 0.230933 10.584676\nLi Mn O F\n4 8 12 4\ndirect\n0.056805 0.572017 0.767102 Li\n0.550595 0.122377 0.735853 Li\n0.050595 0.877623 0.264147 Li\n0.556805 0.427983 0.232898 Li\n0.497614 0.514326 0.507627 Mn\n0.247698 0.001518 0.505817 Mn\n0.747698 0.998482 0.494183 Mn\n0.997614 0.485674 0.492373 Mn\n0.989173 0.494904 0.018454 Mn\n0.235277 0.010809 0.995175 Mn\n0.735277 0.989191 0.004825 Mn\n0.489173 0.505096 0.981546 Mn\n0.743423 0.317286 0.583146 O\n0.251113 0.326769 0.589573 O\n0.503366 0.882454 0.597895 O\n0.003366 0.117546 0.402105 O\n0.243423 0.682714 0.416854 O\n0.751113 0.673231 0.410427 O\n0.721601 0.613480 0.097514 O\n0.983043 0.155180 0.091790 O\n0.489314 0.187176 0.077476 O\n0.989314 0.812824 0.922524 O\n0.483043 0.844820 0.908210 O\n0.221601 0.386520 0.902486 O\n0.999859 0.800399 0.632706 F\n0.499859 0.199601 0.367294 F\n0.231120 0.680435 0.140796 F\n0.731120 0.319565 0.859204 F\n",
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},
{
"id": "mp-1096646",
"created_at": "2022-09-04T14:40:37.945569Z",
"structure_string": "Li2 Y1 Ga1\n1.0\n-5.803646 5.999582 8.494345\n5.803646 -5.999582 8.494345\n5.803646 5.999582 -8.494345\nLi Y Ga\n2 1 1\ndirect\n0.000000 0.233642 0.233642 Li\n0.000000 0.766358 0.766358 Li\n0.000000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Ga\n",
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"formula_full": "Li2 Y1 Ga1",
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"updated_at": "2021-11-28T01:34:56.890000Z",
"spacegroup": 71
},
{
"id": "mp-1212955",
"created_at": "2022-09-04T14:40:30.249480Z",
"structure_string": "Eu4 Be4 Si2 O14\n1.0\n7.447166 0.000000 0.000000\n0.000000 7.447166 0.000000\n0.000000 0.000000 4.929470\nEu Be Si O\n4 4 2 14\ndirect\n0.161361 0.338639 0.503675 Eu\n0.838639 0.661361 0.503675 Eu\n0.661361 0.161361 0.496325 Eu\n0.338639 0.838639 0.496325 Eu\n0.636212 0.863788 0.955259 Be\n0.363788 0.136212 0.955259 Be\n0.136212 0.636212 0.044741 Be\n0.863788 0.363788 0.044741 Be\n0.000000 0.000000 0.000000 Si\n0.500000 0.500000 0.000000 Si\n0.000000 0.500000 0.175189 O\n0.500000 0.000000 0.824811 O\n0.639365 0.860635 0.285288 O\n0.360635 0.139365 0.285288 O\n0.139365 0.639365 0.714712 O\n0.860635 0.360635 0.714712 O\n0.077047 0.835518 0.190848 O\n0.922953 0.164482 0.190848 O\n0.164482 0.077047 0.809152 O\n0.422953 0.335518 0.809152 O\n0.835518 0.922953 0.809152 O\n0.577047 0.664482 0.809152 O\n0.335518 0.577047 0.190848 O\n0.664482 0.422953 0.190848 O\n",
"nsites": 24,
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],
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"formula_full": "Eu4 Be4 Si2 O14",
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"updated_at": "2021-11-28T01:34:56.886000Z",
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},
{
"id": "mp-755632",
"created_at": "2022-09-04T14:40:15.762796Z",
"structure_string": "Li4 Fe4 F16\n1.0\n4.855453 0.000000 0.000000\n0.000000 5.707593 0.000000\n0.000000 0.893424 10.137622\nLi Fe F\n4 4 16\ndirect\n0.460199 0.577713 0.628318 Li\n0.039801 0.577713 0.128318 Li\n0.960199 0.422287 0.871682 Li\n0.539801 0.422287 0.371682 Li\n0.467396 0.863657 0.874501 Fe\n0.032604 0.863657 0.374501 Fe\n0.967396 0.136343 0.625499 Fe\n0.532604 0.136343 0.125499 Fe\n0.262228 0.917687 0.706141 F\n0.237772 0.917687 0.206141 F\n0.821912 0.851760 0.544148 F\n0.678088 0.851760 0.044148 F\n0.179509 0.667776 0.949495 F\n0.320491 0.667776 0.449495 F\n0.646176 0.608826 0.799973 F\n0.853824 0.608826 0.299973 F\n0.146176 0.391174 0.700027 F\n0.353824 0.391174 0.200027 F\n0.679509 0.332224 0.550505 F\n0.820491 0.332224 0.050505 F\n0.321912 0.148240 0.955852 F\n0.178088 0.148240 0.455852 F\n0.762228 0.082313 0.793859 F\n0.737772 0.082313 0.293859 F\n",
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"formula_full": "Li4 Fe4 F16",
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"updated_at": "2021-11-28T01:34:56.881000Z",
"spacegroup": 14
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{
"id": "mp-30973",
"created_at": "2022-09-04T14:40:52.450976Z",
"structure_string": "Ni6 Bi4 Se4\n1.0\n4.110251 5.634676 0.000000\n-4.110251 5.634676 0.000000\n0.000000 5.555200 5.941635\nNi Bi Se\n6 4 4\ndirect\n0.273029 0.726971 0.500000 Ni\n0.726971 0.273029 0.500000 Ni\n0.983120 0.983120 0.788465 Ni\n0.016880 0.016880 0.211535 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.000000 0.500000 Ni\n0.784225 0.784225 0.699335 Bi\n0.215775 0.215775 0.300665 Bi\n0.749321 0.749321 0.257312 Bi\n0.250679 0.250679 0.742688 Bi\n0.255659 0.693442 0.807139 Se\n0.306558 0.744341 0.192861 Se\n0.744341 0.306558 0.192861 Se\n0.693442 0.255659 0.807139 Se\n",
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"volume": 275.21573302428106,
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"formula_full": "Ni6 Bi4 Se4",
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{
"id": "mp-29722",
"created_at": "2022-09-04T14:40:27.780259Z",
"structure_string": "Ca22 In2 Sb18\n1.0\n-5.971053 6.312822 8.431790\n5.971053 -6.312822 8.431790\n5.971053 6.312822 -8.431790\nCa In Sb\n22 2 18\ndirect\n0.432199 0.226491 0.350787 Ca\n0.875704 0.081412 0.649213 Ca\n0.932199 0.581412 0.205708 Ca\n0.375704 0.726491 0.794292 Ca\n0.571584 0.942682 0.263805 Ca\n0.678877 0.307779 0.736195 Ca\n0.071584 0.807779 0.628902 Ca\n0.178877 0.442682 0.371098 Ca\n0.110214 0.923510 0.360699 Ca\n0.562811 0.749515 0.639301 Ca\n0.610214 0.249515 0.186704 Ca\n0.062811 0.423510 0.813296 Ca\n0.309014 0.682612 0.257711 Ca\n0.424901 0.051303 0.742289 Ca\n0.809014 0.551303 0.626402 Ca\n0.924901 0.182612 0.373598 Ca\n0.819222 0.158807 0.987752 Ca\n0.171054 0.831470 0.012248 Ca\n0.319222 0.331470 0.660415 Ca\n0.671054 0.658807 0.339585 Ca\n0.669414 0.669414 0.000000 Ca\n0.169414 0.169414 0.000000 Ca\n0.386413 0.386413 0.000000 In\n0.886413 0.886413 0.000000 In\n0.381714 0.636075 0.015543 Sb\n0.620531 0.366171 0.984457 Sb\n0.881714 0.866171 0.745640 Sb\n0.120531 0.136075 0.254360 Sb\n0.747512 0.247512 0.500000 Sb\n0.247512 0.747512 0.500000 Sb\n0.501768 0.502680 0.647509 Sb\n0.855171 0.854259 0.352491 Sb\n0.001768 0.354259 0.999088 Sb\n0.355171 0.002680 0.000912 Sb\n0.383715 0.028474 0.426279 Sb\n0.602195 0.957435 0.573721 Sb\n0.883715 0.457435 0.355240 Sb\n0.102195 0.528474 0.644760 Sb\n0.159350 0.150943 0.702387 Sb\n0.448556 0.456963 0.297613 Sb\n0.659350 0.956963 0.008407 Sb\n0.948556 0.650943 0.991593 Sb\n",
"nsites": 42,
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],
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"formula_full": "Ca22 In2 Sb18",
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{
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"structure_string": "Sm1 Ni5\n1.0\n2.458570 -4.258368 0.000000\n2.458570 4.258368 0.000000\n0.000000 0.000000 3.956314\nSm Ni\n1 5\ndirect\n0.000000 0.000000 0.000000 Sm\n0.333333 0.666667 0.000000 Ni\n0.666667 0.333333 0.000000 Ni\n0.500000 0.000000 0.500000 Ni\n0.500000 0.500000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n",
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{
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"structure_string": "Ca2 Al4 Si4 O20\n1.0\n2.958035 -4.393875 0.000000\n2.958035 4.393875 0.000000\n0.000000 0.000000 12.956622\nCa Al Si O\n2 4 4 20\ndirect\n0.664890 0.335110 0.750000 Ca\n0.335110 0.664890 0.250000 Ca\n0.500000 0.000000 0.000000 Al\n0.000000 0.500000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.022087 0.977913 0.868637 Si\n0.977913 0.022087 0.131363 Si\n0.022087 0.977913 0.631363 Si\n0.977913 0.022087 0.368637 Si\n0.950758 0.049242 0.750000 O\n0.049242 0.950758 0.250000 O\n0.353285 0.101011 0.882155 O\n0.101011 0.353285 0.117845 O\n0.353285 0.101011 0.617845 O\n0.101011 0.353285 0.382155 O\n0.646715 0.898989 0.117845 O\n0.898989 0.646715 0.882155 O\n0.646715 0.898989 0.382155 O\n0.898989 0.646715 0.617845 O\n0.863183 0.136817 0.936311 O\n0.136817 0.863183 0.063689 O\n0.863183 0.136817 0.563689 O\n0.136817 0.863183 0.436311 O\n0.364138 0.635862 0.946950 O\n0.635862 0.364138 0.053050 O\n0.364138 0.635862 0.553050 O\n0.635862 0.364138 0.446950 O\n0.384510 0.615490 0.750000 O\n0.615490 0.384510 0.250000 O\n",
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"formula_full": "Ca2 Al4 Si4 O20",
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{
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"structure_string": "Na6 Bi2\n1.0\n2.742293 -4.749790 0.000000\n2.742293 4.749790 0.000000\n0.000000 0.000000 9.761834\nNa Bi\n6 2\ndirect\n0.333333 0.666667 0.917251 Na\n0.666667 0.333333 0.417251 Na\n0.000000 0.000000 0.250000 Na\n0.000000 0.000000 0.750000 Na\n0.333333 0.666667 0.582749 Na\n0.666667 0.333333 0.082749 Na\n0.666667 0.333333 0.750000 Bi\n0.333333 0.666667 0.250000 Bi\n",
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{
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