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{
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{
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"structure_string": "Sr1 Nd1 Zr1 Ti1 O6\n1.0\n0.000000 -4.059357 -4.059357\n4.059357 0.000000 -4.059357\n4.059357 -4.059357 0.000000\nSr Nd Zr Ti O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Nd\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Ti\n0.756833 0.243167 0.243167 O\n0.243167 0.756833 0.756833 O\n0.756833 0.243167 0.756833 O\n0.243167 0.756833 0.243167 O\n0.756833 0.756833 0.243167 O\n0.243167 0.243167 0.756833 O\n",
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"formula_full": "Sr1 Nd1 Zr1 Ti1 O6",
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{
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"structure_string": "Ba1 Na1 Eu1 Mn1 O6\n1.0\n0.000000 -4.069583 -4.069583\n4.069583 0.000000 -4.069583\n4.069583 -4.069583 -0.000000\nBa Na Eu Mn O\n1 1 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.500000 0.500000 0.500000 Na\n0.750000 0.750000 0.750000 Eu\n0.000000 -0.000000 -0.000000 Mn\n0.768981 0.231019 0.231019 O\n0.231019 0.768981 0.768981 O\n0.768981 0.231019 0.768981 O\n0.231019 0.768981 0.231019 O\n0.768981 0.768981 0.231019 O\n0.231019 0.231019 0.768981 O\n",
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{
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"structure_string": "Ba1 Ca1 Sm1 Sb1 O6\n1.0\n0.000000 -4.265113 -4.265113\n4.265113 0.000000 -4.265113\n4.265113 -4.265113 0.000000\nBa Ca Sm Sb O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Ca\n0.500000 0.500000 0.500000 Sm\n0.000000 0.000000 0.000000 Sb\n0.765610 0.234390 0.234390 O\n0.234390 0.765610 0.765610 O\n0.765610 0.234390 0.765610 O\n0.234390 0.765610 0.234390 O\n0.765610 0.765610 0.234390 O\n0.234390 0.234390 0.765610 O\n",
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"formula_full": "Ba1 Ca1 Sm1 Sb1 O6",
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"spacegroup": 216
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{
"id": "mp-1278576",
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"structure_string": "Sr4 Ca4 Ti4 Mn4 O24\n1.0\n-2.734814 -2.734974 -3.867835\n-2.691176 8.190335 -3.888307\n8.186553 -2.691356 -3.885974\nSr Ca Ti Mn O\n4 4 4 4 24\ndirect\n0.500046 0.623582 0.372114 Sr\n0.999908 0.878300 0.625875 Sr\n0.499979 0.123619 0.872190 Sr\n0.999965 0.378288 0.125779 Sr\n0.500009 0.875419 0.131611 Ca\n0.999981 0.118890 0.374106 Ca\n0.499930 0.375442 0.631668 Ca\n0.999990 0.618888 0.874195 Ca\n0.999974 0.994751 0.002497 Ti\n0.499993 0.247680 0.255207 Ti\n0.000019 0.494687 0.502466 Ti\n0.499954 0.747693 0.755347 Ti\n0.000046 0.750028 0.248448 Mn\n0.500107 0.001937 0.500170 Mn\n0.000040 0.249942 0.748208 Mn\n0.499926 0.501942 0.999946 Mn\n0.000019 0.653880 0.397595 O\n0.499879 0.851998 0.595871 O\n0.999964 0.153875 0.897459 O\n0.499981 0.352055 0.095798 O\n0.999979 0.838360 0.091526 O\n0.499991 0.158387 0.411850 O\n0.000281 0.338311 0.591397 O\n0.500155 0.658548 0.911863 O\n0.249743 0.886901 0.861405 O\n0.749955 0.106578 0.142273 O\n0.249583 0.387027 0.361394 O\n0.750097 0.606569 0.642303 O\n0.250013 0.106579 0.142272 O\n0.750398 0.387009 0.361394 O\n0.250093 0.606162 0.642783 O\n0.750218 0.886926 0.861399 O\n0.250326 0.611162 0.140216 O\n0.750206 0.898791 0.352650 O\n0.250427 0.111145 0.640232 O\n0.750234 0.398772 0.852673 O\n0.249779 0.898795 0.352659 O\n0.749496 0.111181 0.640252 O\n0.249705 0.398766 0.852693 O\n0.749611 0.611139 0.140213 O\n",
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{
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"structure_string": "Ba1 Ca1 Dy1 V1 O6\n1.0\n0.000000 -4.122051 -4.122051\n4.122051 0.000000 -4.122051\n4.122051 -4.122051 0.000000\nBa Ca Dy V O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Ba\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Dy\n0.500000 0.500000 0.500000 V\n0.730974 0.269026 0.269026 O\n0.269026 0.730974 0.730974 O\n0.730974 0.269026 0.730974 O\n0.269026 0.730974 0.269026 O\n0.730974 0.730974 0.269026 O\n0.269026 0.269026 0.730974 O\n",
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{
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"structure_string": "K4 Ba4 Ce4 W4 O24\n1.0\n8.532365 0.000000 0.000000\n0.000000 8.567029 0.000000\n0.000000 0.000000 8.555171\nK Ba Ce W O\n4 4 4 4 24\ndirect\n-0.000000 0.500000 0.500000 K\n0.500000 0.500000 -0.000000 K\n0.500000 -0.000000 0.000000 K\n-0.000000 -0.000000 0.500000 K\n0.500000 -0.000000 0.500000 Ba\n-0.000000 0.500000 -0.000000 Ba\n-0.000000 -0.000000 -0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.750000 0.750000 0.750000 Ce\n0.250000 0.250000 0.750000 Ce\n0.250000 0.750000 0.250000 Ce\n0.750000 0.250000 0.250000 Ce\n0.250000 0.250000 0.250000 W\n0.750000 0.750000 0.250000 W\n0.750000 0.250000 0.750000 W\n0.250000 0.750000 0.750000 W\n0.021068 0.238931 0.254974 O\n0.978932 0.761069 0.254974 O\n0.978932 0.238931 0.745026 O\n0.021068 0.761069 0.745026 O\n0.260008 0.010184 0.246806 O\n0.260008 0.989816 0.753194 O\n0.739992 0.989816 0.246806 O\n0.739992 0.010184 0.753194 O\n0.230124 0.253057 0.010554 O\n0.769876 0.253057 0.989446 O\n0.230124 0.746943 0.989446 O\n0.769876 0.746943 0.010554 O\n0.478932 0.261069 0.245026 O\n0.521068 0.738931 0.245026 O\n0.521068 0.261069 0.754974 O\n0.478932 0.738931 0.754974 O\n0.239992 0.489816 0.253194 O\n0.239992 0.510184 0.746806 O\n0.760008 0.510184 0.253194 O\n0.760008 0.489816 0.746806 O\n0.269876 0.246943 0.489446 O\n0.730124 0.246943 0.510554 O\n0.269876 0.753057 0.510554 O\n0.730124 0.753057 0.489446 O\n",
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{
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{
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"structure_string": "La2 Mg2 Fe2 Sb2 O12\n1.0\n5.649403 0.000000 0.000000\n0.000000 5.427619 0.000000\n0.000000 5.431081 8.099418\nLa Mg Fe Sb O\n2 2 2 2 12\ndirect\n0.205247 0.734173 0.250852 La\n0.794753 0.734173 0.750852 La\n0.692634 0.274101 0.255981 Mg\n0.307366 0.274101 0.755981 Mg\n0.751162 0.002016 0.998362 Fe\n0.248838 0.002016 0.498362 Fe\n0.746057 0.503430 0.498277 Sb\n0.253943 0.503430 0.998277 Sb\n0.209501 0.879830 0.769245 O\n0.061705 0.256288 0.938502 O\n0.045771 0.601252 0.573152 O\n0.954229 0.601252 0.073152 O\n0.938295 0.256288 0.438502 O\n0.790499 0.879830 0.269245 O\n0.680143 0.165070 0.733299 O\n0.531155 0.720749 0.559486 O\n0.517492 0.363091 0.922844 O\n0.482508 0.363091 0.422844 O\n0.468845 0.720749 0.059486 O\n0.319857 0.165070 0.233299 O\n",
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{
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},
{
"id": "mp-1519348",
"created_at": "2022-09-04T14:41:34.884444Z",
"structure_string": "Ba4 Sr4 Pr4 Nb4 O24\n1.0\n8.608726 0.000000 0.000000\n0.000000 8.626495 0.000000\n0.000000 0.000000 8.615055\nBa Sr Pr Nb O\n4 4 4 4 24\ndirect\n0.000000 -0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Ba\n0.000000 0.500000 0.000000 Ba\n0.000000 -0.000000 0.500000 Ba\n0.000000 0.500000 0.500000 Sr\n0.500000 -0.000000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.500000 -0.000000 0.000000 Sr\n0.252288 0.250360 0.251805 Pr\n0.747712 0.749640 0.251805 Pr\n0.747712 0.250360 0.748195 Pr\n0.252288 0.749640 0.748195 Pr\n0.746231 0.749075 0.750388 Nb\n0.253769 0.250925 0.750388 Nb\n0.253769 0.749075 0.249612 Nb\n0.746231 0.250925 0.249612 Nb\n0.979364 0.218155 0.275720 O\n0.020636 0.781845 0.275720 O\n0.020636 0.218155 0.724280 O\n0.979364 0.781845 0.724280 O\n0.288091 0.980505 0.212814 O\n0.288091 0.019495 0.787186 O\n0.711909 0.019495 0.212814 O\n0.711909 0.980505 0.787186 O\n0.221373 0.279330 0.981485 O\n0.778627 0.279330 0.018515 O\n0.221373 0.720670 0.018515 O\n0.778627 0.720670 0.981485 O\n0.519420 0.297731 0.214063 O\n0.480580 0.702269 0.214063 O\n0.480580 0.297731 0.785937 O\n0.519420 0.702269 0.785937 O\n0.216062 0.520422 0.294842 O\n0.216062 0.479578 0.705158 O\n0.783938 0.479578 0.294842 O\n0.783938 0.520422 0.705158 O\n0.293947 0.210659 0.521729 O\n0.706053 0.210659 0.478271 O\n0.293947 0.789341 0.478271 O\n0.706053 0.789341 0.521729 O\n",
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"updated_at": "2021-11-28T01:35:20.283000Z",
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}
]
}