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{
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],
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"formula_full": "Tm4 Mg2 Ge4",
"formula_reduced": "Tm2MgGe2",
"formula_anonymous": "AB2C2",
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"spacegroup": 127
},
{
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"created_at": "2022-09-04T14:39:58.466480Z",
"structure_string": "Er4 Ge4 Ru4\n1.0\n4.395502 0.000000 0.000000\n0.000000 6.998156 0.000000\n0.000000 0.000000 7.256553\nEr Ge Ru\n4 4 4\ndirect\n0.250000 0.487843 0.192194 Er\n0.750000 0.512157 0.807806 Er\n0.250000 0.987843 0.307806 Er\n0.750000 0.012157 0.692194 Er\n0.250000 0.795705 0.892898 Ge\n0.750000 0.204295 0.107102 Ge\n0.250000 0.295705 0.607102 Ge\n0.750000 0.704295 0.392898 Ge\n0.750000 0.844087 0.062691 Ru\n0.250000 0.155913 0.937309 Ru\n0.750000 0.344087 0.437309 Ru\n0.250000 0.655913 0.562691 Ru\n",
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],
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"formula_full": "Er4 Ge4 Ru4",
"formula_reduced": "ErGeRu",
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},
{
"id": "mp-1196979",
"created_at": "2022-09-04T14:48:30.432170Z",
"structure_string": "Mo4 Pb4 Se4 O24\n1.0\n-7.061850 0.000000 0.000000\n-0.026795 -7.332370 0.000000\n1.945563 1.796812 10.777909\nMo Pb Se O\n4 4 4 24\ndirect\n0.158698 0.952670 0.800545 Mo\n0.841302 0.047330 0.199455 Mo\n0.159364 0.449962 0.797359 Mo\n0.840636 0.550038 0.202641 Mo\n0.750632 0.861367 0.505720 Pb\n0.249368 0.138633 0.494280 Pb\n0.648745 0.710801 0.841451 Pb\n0.351255 0.289199 0.158549 Pb\n0.290678 0.640512 0.533976 Se\n0.709322 0.359488 0.466024 Se\n0.608608 0.194302 0.784417 Se\n0.391392 0.805698 0.215583 Se\n0.172958 0.047917 0.955865 O\n0.827042 0.952083 0.044135 O\n0.908570 0.889044 0.756285 O\n0.091430 0.110956 0.243715 O\n0.137988 0.184773 0.727935 O\n0.862012 0.815227 0.272065 O\n0.262001 0.710739 0.823553 O\n0.737999 0.289261 0.176447 O\n0.184640 0.842209 0.598540 O\n0.815360 0.157791 0.401460 O\n0.473944 0.023257 0.825274 O\n0.526056 0.976743 0.174726 O\n0.183823 0.430894 0.953465 O\n0.816177 0.569106 0.046535 O\n0.914091 0.501938 0.757919 O\n0.085909 0.498062 0.242081 O\n0.204780 0.465631 0.603381 O\n0.795220 0.534369 0.396619 O\n0.478424 0.393235 0.813233 O\n0.521576 0.606765 0.186767 O\n0.528028 0.673277 0.608839 O\n0.471972 0.326723 0.391161 O\n0.563547 0.140058 0.623255 O\n0.436453 0.859942 0.376745 O\n",
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"elements": [
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"chemical_system": "Mo-O-Pb-Se",
"density": 5.690195521621408,
"density_atomic": 0.06450674499007099,
"volume": 558.0811743879062,
"volume_molar": 9.33567607686133,
"formula_full": "Mo4 Pb4 Se4 O24",
"formula_reduced": "MoPbSeO6",
"formula_anonymous": "ABCD6",
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"updated_at": "2021-11-28T01:39:45.406000Z",
"spacegroup": 2
}
]
}