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{
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{
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{
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{
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{
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{
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"structure_string": "U6 Cu4 Se14\n1.0\n5.079509 -8.797967 0.000000\n5.079509 8.797967 0.000000\n0.000000 0.000000 5.970387\nU Cu Se\n6 4 14\ndirect\n0.847767 0.621391 0.526727 U\n0.226376 0.847767 0.026727 U\n0.152233 0.378609 0.026727 U\n0.378609 0.226376 0.526727 U\n0.621391 0.773624 0.026727 U\n0.773624 0.152233 0.526727 U\n0.666667 0.333333 0.159125 Cu\n0.000000 0.000000 0.000175 Cu\n0.333333 0.666667 0.659125 Cu\n0.000000 0.000000 0.500175 Cu\n0.076455 0.564444 0.779191 Se\n0.264557 0.154444 0.013645 Se\n0.435556 0.512011 0.779191 Se\n0.666667 0.333333 0.753110 Se\n0.154444 0.889887 0.513645 Se\n0.889887 0.735443 0.013645 Se\n0.333333 0.666667 0.253110 Se\n0.110113 0.264557 0.513645 Se\n0.512011 0.076455 0.279191 Se\n0.923545 0.435556 0.279191 Se\n0.564444 0.487989 0.279191 Se\n0.735443 0.845556 0.513645 Se\n0.487989 0.923545 0.779191 Se\n0.845556 0.110113 0.013645 Se\n",
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"elements": [
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],
"chemical_system": "Cu-Se-U",
"density": 8.675085705004882,
"density_atomic": 0.04497536538137789,
"volume": 533.6254591038238,
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"formula_full": "U6 Cu4 Se14",
"formula_reduced": "U3Cu2Se7",
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},
{
"id": "mp-777972",
"created_at": "2022-09-04T14:40:11.726669Z",
"structure_string": "Li8 Mn8 F24\n1.0\n5.465863 0.000000 0.000000\n0.000000 9.035989 0.000000\n0.000000 0.000000 10.052948\nLi Mn F\n8 8 24\ndirect\n0.183006 0.165366 0.004793 Li\n0.151717 0.827560 0.781962 Li\n0.348283 0.327560 0.281962 Li\n0.316994 0.665366 0.504793 Li\n0.683006 0.334634 0.004793 Li\n0.651717 0.672440 0.781962 Li\n0.848283 0.172440 0.281962 Li\n0.816994 0.834634 0.504793 Li\n0.156392 0.477450 0.807203 Mn\n0.161494 0.143298 0.572073 Mn\n0.338506 0.643298 0.072073 Mn\n0.343608 0.977450 0.307203 Mn\n0.656392 0.022550 0.807203 Mn\n0.661494 0.356702 0.572073 Mn\n0.838506 0.856702 0.072073 Mn\n0.843608 0.522550 0.307203 Mn\n0.007660 0.332342 0.942232 F\n0.013731 0.998418 0.431572 F\n0.041634 0.681485 0.932017 F\n0.176541 0.825353 0.172317 F\n0.172189 0.156405 0.199023 F\n0.174058 0.492121 0.201198 F\n0.325942 0.992121 0.701198 F\n0.327811 0.656405 0.699023 F\n0.323459 0.325353 0.672317 F\n0.458366 0.181485 0.432017 F\n0.486269 0.498418 0.931572 F\n0.492340 0.832342 0.442232 F\n0.507660 0.167658 0.942232 F\n0.513731 0.501582 0.431572 F\n0.541634 0.818515 0.932017 F\n0.676541 0.674647 0.172317 F\n0.672189 0.343595 0.199023 F\n0.674058 0.007879 0.201198 F\n0.825942 0.507879 0.701198 F\n0.827811 0.843595 0.699023 F\n0.823459 0.174647 0.672317 F\n0.958366 0.318515 0.432017 F\n0.986269 0.001582 0.931572 F\n0.992340 0.667658 0.442232 F\n",
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"elements": [
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],
"chemical_system": "F-Li-Mn",
"density": 3.180526507250842,
"density_atomic": 0.08056234879724242,
"volume": 496.5098535132229,
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"formula_full": "Li8 Mn8 F24",
"formula_reduced": "LiMnF3",
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"updated_at": "2021-11-28T01:34:52.786000Z",
"spacegroup": 33
},
{
"id": "mp-558690",
"created_at": "2022-09-04T14:39:10.656524Z",
"structure_string": "Zn2 B8 O14\n1.0\n3.274346 -5.456846 0.000000\n3.274346 5.456846 0.000000\n0.000000 0.000000 5.221128\nZn B O\n2 8 14\ndirect\n0.766103 0.766103 0.750000 Zn\n0.233897 0.233897 0.250000 Zn\n0.702429 0.297571 0.500000 B\n0.297571 0.702429 0.000000 B\n0.702429 0.297571 0.000000 B\n0.689564 0.924631 0.250000 B\n0.924631 0.689564 0.250000 B\n0.297571 0.702429 0.500000 B\n0.075369 0.310436 0.750000 B\n0.310436 0.075369 0.750000 B\n0.920341 0.920341 0.250000 O\n0.445806 0.189307 0.976941 O\n0.079659 0.079659 0.750000 O\n0.554194 0.810693 0.023059 O\n0.810693 0.554194 0.476941 O\n0.195503 0.754926 0.250000 O\n0.445806 0.189307 0.523059 O\n0.189307 0.445806 0.976941 O\n0.245074 0.804497 0.750000 O\n0.810693 0.554194 0.023059 O\n0.754926 0.195503 0.250000 O\n0.189307 0.445806 0.523059 O\n0.804497 0.245074 0.750000 O\n0.554194 0.810693 0.476941 O\n",
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"chemical_system": "B-O-Zn",
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"density_atomic": 0.1286324787901658,
"volume": 186.57807286097986,
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"formula_full": "Zn2 B8 O14",
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"updated_at": "2021-11-28T01:34:24.085000Z",
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]
}