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{
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{
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"formula_full": "Li4 P8 W4 O32",
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},
{
"id": "mp-23637",
"created_at": "2022-09-04T14:47:56.442088Z",
"structure_string": "V2 Bi2 Pb2 O10\n1.0\n2.827845 6.711918 0.000000\n-2.827845 6.711918 0.000000\n0.000000 2.664217 6.778965\nV Bi Pb O\n2 2 2 10\ndirect\n0.834306 0.834306 0.647971 V\n0.165694 0.165694 0.352029 V\n0.487082 0.487082 0.250307 Bi\n0.512918 0.512918 0.749693 Bi\n0.842324 0.842324 0.112476 Pb\n0.157676 0.157676 0.887524 Pb\n0.736871 0.263129 0.000000 O\n0.263129 0.736871 0.000000 O\n0.304428 0.304428 0.285860 O\n0.695572 0.695572 0.714140 O\n0.383777 0.885064 0.240625 O\n0.114936 0.616223 0.759375 O\n0.100176 0.100176 0.606758 O\n0.899824 0.899824 0.393242 O\n0.885064 0.383777 0.240625 O\n0.616223 0.114936 0.759375 O\n",
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"volume": 257.3330873950112,
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"formula_full": "V2 Bi2 Pb2 O10",
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{
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"structure_string": "Li1 Nd1 Sn1\n1.0\n0.000000 3.369778 3.369778\n3.369778 0.000000 3.369778\n3.369778 3.369778 0.000000\nLi Nd Sn\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.500000 0.500000 0.500000 Nd\n0.000000 0.000000 0.000000 Sn\n",
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"formula_full": "Li1 Nd1 Sn1",
"formula_reduced": "LiNdSn",
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"spacegroup": 216
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{
"id": "mp-1183054",
"created_at": "2022-09-04T14:47:56.452882Z",
"structure_string": "Ac2 Ga1 Si1\n1.0\n0.000000 3.888966 3.888966\n3.888966 0.000000 3.888966\n3.888966 3.888966 0.000000\nAc Ga Si\n2 1 1\ndirect\n0.750000 0.750000 0.750000 Ac\n0.250000 0.250000 0.250000 Ac\n0.500000 0.500000 0.500000 Ga\n0.000000 0.000000 0.000000 Si\n",
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{
"id": "mp-778044",
"created_at": "2022-09-04T14:47:56.459350Z",
"structure_string": "Li2 V2 F8\n1.0\n5.115417 0.000000 0.000000\n-0.038085 5.172098 0.000000\n-1.193259 -0.214595 5.044224\nLi V F\n2 2 8\ndirect\n0.180006 0.499091 0.742056 Li\n0.819994 0.500909 0.257944 Li\n0.695601 0.949623 0.789983 V\n0.304399 0.050377 0.210017 V\n0.331591 0.855889 0.547091 F\n0.988867 0.794126 0.091020 F\n0.489226 0.758965 0.029427 F\n0.829893 0.661918 0.601340 F\n0.170107 0.338082 0.398660 F\n0.510774 0.241035 0.970573 F\n0.011133 0.205874 0.908980 F\n0.668409 0.144111 0.452909 F\n",
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"formula_full": "Li2 V2 F8",
"formula_reduced": "LiVF4",
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{
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"structure_string": "K6 Sr2\n1.0\n4.603434 -7.973382 0.000000\n4.603434 7.973382 0.000000\n0.000000 0.000000 7.510620\nK Sr\n6 2\ndirect\n0.167943 0.335886 0.250000 K\n0.664114 0.832057 0.250000 K\n0.167943 0.832057 0.250000 K\n0.832057 0.664114 0.750000 K\n0.335886 0.167943 0.750000 K\n0.832057 0.167943 0.750000 K\n0.333333 0.666667 0.750000 Sr\n0.666667 0.333333 0.250000 Sr\n",
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{
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"structure_string": "Li8 V4 O8 F4\n1.0\n-0.004102 5.191335 0.009884\n0.006447 0.014023 7.369753\n5.993086 -0.004737 0.005345\nLi V O F\n8 4 8 4\ndirect\n0.658206 0.848855 0.000881 Li\n0.340333 0.156311 0.999141 Li\n0.296964 0.137845 0.500839 Li\n0.692749 0.856043 0.499230 Li\n0.851664 0.132246 0.259272 Li\n0.853118 0.132245 0.739623 Li\n0.155766 0.855414 0.267656 Li\n0.157257 0.855422 0.733232 Li\n0.495181 0.508458 0.242533 V\n0.494419 0.507097 0.757555 V\n0.000613 0.501134 0.999945 V\n0.008617 0.503801 0.499870 V\n0.331104 0.659507 0.999155 O\n0.655587 0.353914 0.000936 O\n0.344146 0.647601 0.500043 O\n0.997861 0.997878 0.499971 O\n0.832664 0.647155 0.252010 O\n0.832604 0.645633 0.747491 O\n0.167751 0.353142 0.251395 O\n0.167974 0.351890 0.748541 O\n0.998570 0.001243 0.000050 F\n0.664828 0.339196 0.500544 F\n0.500579 0.004256 0.242951 F\n0.501441 0.003715 0.757090 F\n",
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{
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"structure_string": "Ba4 Ga8 Ge8 O32\n1.0\n10.071966 0.000000 0.000000\n0.000000 8.910949 0.000000\n0.000000 0.063503 9.480379\nBa Ga Ge O\n4 8 8 32\ndirect\n0.412570 0.749404 0.891197 Ba\n0.912570 0.250596 0.608803 Ba\n0.587430 0.250596 0.108803 Ba\n0.087430 0.749404 0.391197 Ba\n0.192527 0.429151 0.061740 Ga\n0.692527 0.570849 0.438260 Ga\n0.807473 0.570849 0.938260 Ga\n0.307473 0.429151 0.561740 Ga\n0.920359 0.067703 0.228734 Ga\n0.420359 0.932297 0.271266 Ga\n0.079641 0.932297 0.771266 Ga\n0.579641 0.067703 0.728734 Ga\n0.196838 0.062687 0.064274 Ge\n0.696838 0.937313 0.435726 Ge\n0.803162 0.937313 0.935726 Ge\n0.303162 0.062687 0.564274 Ge\n0.916924 0.436876 0.234772 Ge\n0.416924 0.563124 0.265228 Ge\n0.083076 0.563124 0.765228 Ge\n0.583076 0.436876 0.734772 Ge\n0.089516 0.992630 0.199387 O\n0.589516 0.007370 0.300613 O\n0.910484 0.007370 0.800613 O\n0.410484 0.992630 0.699387 O\n0.077293 0.506676 0.197235 O\n0.577293 0.493324 0.302765 O\n0.922707 0.493324 0.802765 O\n0.422707 0.506676 0.697235 O\n0.364671 0.057902 0.123118 O\n0.864671 0.942098 0.376882 O\n0.635329 0.942098 0.876882 O\n0.135329 0.057902 0.623118 O\n0.367339 0.442382 0.125606 O\n0.867339 0.557618 0.374394 O\n0.632661 0.557618 0.874394 O\n0.132661 0.442382 0.625606 O\n0.191773 0.930940 0.924571 O\n0.691773 0.069060 0.575429 O\n0.808227 0.069060 0.075429 O\n0.308227 0.930940 0.424571 O\n0.191904 0.563871 0.910337 O\n0.691904 0.436129 0.589663 O\n0.808096 0.436129 0.089663 O\n0.308096 0.563871 0.410337 O\n0.145689 0.240032 0.005137 O\n0.645689 0.759968 0.494863 O\n0.854311 0.759968 0.994863 O\n0.354311 0.240032 0.505137 O\n0.913158 0.255364 0.314170 O\n0.413158 0.744636 0.185830 O\n0.086842 0.744636 0.685830 O\n0.586842 0.255364 0.814170 O\n",
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"formula_full": "Ba4 Ga8 Ge8 O32",
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{
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{
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],
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"formula_full": "Dy2 Ga1 Cu3",
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},
{
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"created_at": "2022-09-04T14:47:56.507470Z",
"structure_string": "Li5 Mn1 Co2 O8\n1.0\n2.916239 0.000000 0.000000\n0.000000 5.104057 0.000000\n0.000000 1.870358 9.586124\nLi Mn Co O\n5 1 2 8\ndirect\n0.000000 0.250529 0.257082 Li\n0.500000 0.000000 0.500000 Li\n0.000000 0.749471 0.742918 Li\n0.500000 0.500000 0.000000 Li\n0.000000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Mn\n0.500000 0.726578 0.266190 Co\n0.500000 0.273422 0.733810 Co\n0.000000 0.872522 0.362612 O\n0.500000 0.605281 0.636837 O\n0.000000 0.344017 0.877029 O\n0.500000 0.105236 0.111495 O\n0.000000 0.655983 0.122971 O\n0.500000 0.394719 0.363163 O\n0.000000 0.127478 0.637388 O\n0.500000 0.894764 0.888505 O\n",
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],
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"formula_full": "Li5 Mn1 Co2 O8",
"formula_reduced": "Li5Mn(CoO4)2",
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]
}