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{
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{
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},
{
"id": "mp-866106",
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{
"id": "mp-3915",
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"structure_string": "Ba1 Hg1 O2\n1.0\n6.662206 -2.101194 0.000000\n6.662206 2.101194 0.000000\n5.999510 0.000000 3.578532\nBa Hg O\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 Hg\n0.898197 0.898197 0.898197 O\n0.101803 0.101803 0.101803 O\n",
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"updated_at": "2021-11-28T01:37:15.480000Z",
"spacegroup": 166
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{
"id": "mp-556118",
"created_at": "2022-09-04T14:47:15.572076Z",
"structure_string": "Ba6 Hg6 O12\n1.0\n3.490866 -6.046357 0.000000\n3.490866 6.046357 0.000000\n0.000000 0.000000 12.679760\nBa Hg O\n6 6 12\ndirect\n0.333333 0.666667 0.967470 Ba\n0.666667 0.333333 0.467470 Ba\n0.000000 0.000000 0.500000 Ba\n0.333333 0.666667 0.532530 Ba\n0.666667 0.333333 0.032530 Ba\n0.000000 0.000000 0.000000 Ba\n0.174841 0.825159 0.250000 Hg\n0.650317 0.825159 0.250000 Hg\n0.825159 0.174841 0.750000 Hg\n0.349683 0.174841 0.750000 Hg\n0.825159 0.650317 0.750000 Hg\n0.174841 0.349683 0.250000 Hg\n0.650107 0.687362 0.109789 O\n0.687362 0.650107 0.890211 O\n0.037255 0.349893 0.109789 O\n0.349893 0.037255 0.890211 O\n0.687362 0.037255 0.609789 O\n0.312638 0.962745 0.109789 O\n0.037255 0.687362 0.390211 O\n0.650107 0.962745 0.390211 O\n0.962745 0.650107 0.609789 O\n0.962745 0.312638 0.890211 O\n0.349893 0.312638 0.609789 O\n0.312638 0.349893 0.390211 O\n",
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"formula_full": "Ba6 Hg6 O12",
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},
{
"id": "mp-1097574",
"created_at": "2022-09-04T14:44:28.202268Z",
"structure_string": "Ba2 Hg1 Ge1\n1.0\n-6.462767 6.606354 9.292899\n6.462767 -6.606354 9.292899\n6.462767 6.606354 -9.292899\nBa Hg Ge\n2 1 1\ndirect\n0.000000 0.220861 0.220861 Ba\n0.000000 0.779139 0.779139 Ba\n0.000000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Ge\n",
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{
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"structure_string": "Ba1 Hg2 Bi1\n1.0\n0.000000 4.024854 4.024854\n4.024854 0.000000 4.024854\n4.024854 4.024854 0.000000\nBa Hg Bi\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ba\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n0.000000 0.000000 0.000000 Bi\n",
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{
"id": "mp-1093631",
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{
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{
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{
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"structure_string": "Ba4 Hf3 S10\n1.0\n-2.501018 2.501018 17.888755\n2.501018 -2.501018 17.888755\n2.501018 2.501018 -17.888755\nBa Hf S\n4 3 10\ndirect\n0.431470 0.431470 0.000000 Ba\n0.568530 0.568530 0.000000 Ba\n0.299663 0.299663 0.000000 Ba\n0.700337 0.700337 0.000000 Ba\n0.000000 0.000000 0.000000 Hf\n0.857496 0.857496 0.000000 Hf\n0.142504 0.142504 0.000000 Hf\n0.929513 0.929513 0.000000 S\n0.070487 0.070487 0.000000 S\n0.787806 0.787806 0.000000 S\n0.212194 0.212194 0.000000 S\n0.500000 0.000000 0.500000 S\n0.000000 0.500000 0.500000 S\n0.360732 0.860732 0.500000 S\n0.139268 0.639268 0.500000 S\n0.639268 0.139268 0.500000 S\n0.860732 0.360732 0.500000 S\n",
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]
}