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"structure_string": "V1 Cu3 S4\n1.0\n5.391200 0.000000 0.000000\n-0.000000 5.391200 0.000000\n0.000000 0.000000 5.391200\nV Cu S\n1 3 4\ndirect\n0.000000 0.000000 0.000000 V\n0.500000 0.000000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.000000 0.500000 0.000000 Cu\n0.237200 0.237200 0.237200 S\n0.237200 0.762800 0.762800 S\n0.762800 0.237200 0.762800 S\n0.762800 0.762800 0.237200 S\n",
"nsites": 8,
"nelements": 3,
"elements": [
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],
"chemical_system": "Cu-S-V",
"density": 3.9192779184645645,
"density_atomic": 0.05105445645629504,
"volume": 156.69542984652804,
"volume_molar": 11.795524187306214,
"formula_full": "V1 Cu3 S4",
"formula_reduced": "VCu3S4",
"formula_anonymous": "AB3C4",
"mineral_name": "Sulvanite",
"aflow_id": "A3B4C_cP8_215_d_e_a",
"pearson_symbol": "cP8",
"strukturbericht_symbol": "H2_4",
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"spacegroup": 215
},
{
"id": 151,
"created_at": "2022-09-04T14:35:36.537500Z",
"updated_at": "2022-09-04T14:35:36.537516Z",
"structure_string": "Fe2 Cu2 S4\n1.0\n5.289000 -0.000000 -0.000000\n-0.000000 5.289000 0.000000\n-2.644500 -2.644500 5.211500\nCu Fe S\n2 2 4\ndirect\n0.000000 0.000000 0.000000 Cu\n0.250000 0.750000 0.500000 Cu\n0.500000 0.500000 0.000000 Fe\n0.750000 0.250000 0.500000 Fe\n0.382400 0.375000 0.250000 S\n0.867600 0.875000 0.250000 S\n0.625000 0.132400 0.750000 S\n0.125000 0.617600 0.750000 S\n",
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"elements": [
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],
"chemical_system": "Cu-Fe-S",
"density": 4.180757562345477,
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"formula_full": "Fe2 Cu2 S4",
"formula_reduced": "FeCuS2",
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"mineral_name": "Chalcopyrite",
"aflow_id": "ABC2_tI16_122_a_b_d",
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"strukturbericht_symbol": "E1_1",
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}
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}