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"structure_string": "Ba4 Sb1 Ir1\n1.0\n-0.000000 4.770982 4.770982\n4.770982 0.000000 4.770982\n4.770982 4.770982 -0.000000\nBa Sb Ir\n4 1 1\ndirect\n0.126092 0.624636 0.624636 Ba\n0.624636 0.624636 0.624636 Ba\n0.624636 0.126092 0.624636 Ba\n0.624636 0.624636 0.126092 Ba\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Ir\n",
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"volume": 217.1967536876468,
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"formula_full": "Ba4 Sb1 Ir1",
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{
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"created_at": "2022-09-04T14:36:07.154789Z",
"updated_at": "2022-09-04T14:36:07.154819Z",
"structure_string": "Ba4 Be1 Tc1\n1.0\n-0.000000 4.770963 4.770963\n4.770963 -0.000000 4.770963\n4.770963 4.770963 0.000000\nBa Be Tc\n4 1 1\ndirect\n0.123552 0.625482 0.625482 Ba\n0.625482 0.625482 0.625482 Ba\n0.625482 0.123552 0.625482 Ba\n0.625482 0.625482 0.123552 Ba\n0.250000 0.250000 0.250000 Be\n0.000000 0.000000 0.000000 Tc\n",
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"formula_full": "Ba4 Be1 Tc1",
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{
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"created_at": "2022-09-04T14:36:18.880002Z",
"updated_at": "2022-09-04T14:36:18.880032Z",
"structure_string": "Ba2 Sn1 Cl1\n1.0\n0.000000 4.167818 4.167818\n4.167818 0.000000 4.167818\n4.167818 4.167818 -0.000000\nBa Sn Cl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Cl\n",
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{
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"created_at": "2022-09-04T14:36:21.569983Z",
"updated_at": "2022-09-04T14:36:21.570011Z",
"structure_string": "Ba2 Hg1 Br1\n1.0\n0.000000 4.167685 4.167685\n4.167685 0.000000 4.167685\n4.167685 4.167685 0.000000\nBa Hg Br\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750001 Ba\n0.500001 0.500001 0.500001 Hg\n0.000000 0.000000 0.000000 Br\n",
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{
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"created_at": "2022-09-04T14:38:14.099778Z",
"updated_at": "2022-09-04T14:38:14.099805Z",
"structure_string": "Sr2 Pb2\n1.0\n4.669600 -0.000000 0.000000\n0.000000 4.683063 -1.921472\n-0.000000 -0.016458 6.627468\nSr Pb\n2 2\ndirect\n0.250000 0.867064 0.734131 Sr\n0.750000 0.132935 0.265870 Sr\n0.250000 0.586034 0.172069 Pb\n0.750000 0.413965 0.827931 Pb\n",
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"structure_string": "Ba2 Y1 Ti1\n1.0\n0.000000 4.167620 4.167620\n4.167620 0.000000 4.167620\n4.167620 4.167620 0.000000\nBa Y Ti\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Ti\n",
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"created_at": "2022-09-04T14:35:48.170796Z",
"updated_at": "2022-09-04T14:35:48.170824Z",
"structure_string": "Ba4 Ge1 Rh1\n1.0\n0.000000 4.770668 4.770668\n4.770668 0.000000 4.770668\n4.770668 4.770668 -0.000000\nBa Ge Rh\n4 1 1\ndirect\n0.124910 0.625031 0.625031 Ba\n0.625031 0.625031 0.625031 Ba\n0.625031 0.124910 0.625031 Ba\n0.625031 0.625031 0.124910 Ba\n0.250000 0.250000 0.250000 Ge\n0.000000 0.000000 0.000000 Rh\n",
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{
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"created_at": "2022-09-04T14:38:50.074192Z",
"updated_at": "2022-09-04T14:38:50.074210Z",
"structure_string": "Rb1 Te1 Br1\n1.0\n6.246555 -0.000000 -0.000000\n-3.123278 5.409675 0.000000\n0.000000 -0.000000 3.212937\nRb Te Br\n1 1 1\ndirect\n0.333333 0.666667 0.000000 Rb\n0.666667 0.333333 0.000000 Te\n0.000000 0.000000 0.000000 Br\n",
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{
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"structure_string": "Li2 Ca6\n1.0\n7.426781 -0.000000 0.000000\n-3.713390 6.431781 0.000000\n-0.000000 -0.000000 6.060517\nLi Ca\n2 6\ndirect\n0.333333 0.666667 0.750000 Li\n0.666667 0.333333 0.250000 Li\n0.168341 0.336683 0.250000 Ca\n0.663317 0.831658 0.250000 Ca\n0.168341 0.831658 0.250000 Ca\n0.831658 0.663317 0.750000 Ca\n0.336683 0.168341 0.750000 Ca\n0.831658 0.168341 0.750000 Ca\n",
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