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{
"id": "mp-998554",
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"structure_string": "K1 Ag1 Cl3\n1.0\n5.133744 0.000000 0.000000\n0.000000 5.133744 0.000000\n0.000000 0.000000 5.140014\nK Ag Cl\n1 1 3\ndirect\n0.500000 0.500000 0.997811 K\n0.000000 0.000000 0.486040 Ag\n0.500000 0.000000 0.484120 Cl\n0.000000 0.000000 0.985872 Cl\n0.000000 0.500000 0.484120 Cl\n",
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{
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"structure_string": "K2 Ag2 Br6\n1.0\n6.540504 -3.835873 0.000000\n6.540504 3.835873 0.000000\n4.290842 0.000000 6.251463\nK Ag Br\n2 2 6\ndirect\n0.268153 0.268153 0.268153 K\n0.768153 0.768153 0.768153 K\n0.003031 0.003031 0.003031 Ag\n0.503031 0.503031 0.503031 Ag\n0.809491 0.251628 0.696197 Br\n0.696197 0.809491 0.251628 Br\n0.251628 0.696197 0.809491 Br\n0.309491 0.196197 0.751628 Br\n0.196197 0.751628 0.309491 Br\n0.751628 0.309491 0.196197 Br\n",
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{
"id": "mp-998552",
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"spacegroup": 221
},
{
"id": "mp-998543",
"created_at": "2022-09-04T14:48:22.162457Z",
"structure_string": "Ca2 Tc2 O6\n1.0\n4.745100 -2.779760 0.000000\n4.745100 2.779760 0.000000\n3.116670 0.000000 4.530939\nCa Tc O\n2 2 6\ndirect\n0.735018 0.735018 0.735018 Ca\n0.235018 0.235018 0.235018 Ca\n0.995018 0.995018 0.995018 Tc\n0.495018 0.495018 0.495018 Tc\n0.327683 0.750061 0.163727 O\n0.750061 0.163727 0.327683 O\n0.163727 0.327683 0.750061 O\n0.250061 0.827683 0.663727 O\n0.663727 0.250061 0.827683 O\n0.827683 0.663727 0.250061 O\n",
"nsites": 10,
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"density": 5.170101151039446,
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"formula_full": "Ca2 Tc2 O6",
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{
"id": "mp-998537",
"created_at": "2022-09-04T14:47:16.217522Z",
"structure_string": "Zn2 Ag2 F6\n1.0\n5.746155 -2.769085 0.000000\n5.746155 2.769085 0.000000\n4.411728 0.000000 4.606820\nZn Ag F\n2 2 6\ndirect\n0.658815 0.658815 0.658815 Zn\n0.341185 0.341185 0.341185 Zn\n0.858426 0.858426 0.858426 Ag\n0.141574 0.141574 0.141574 Ag\n0.691292 0.058732 0.459022 F\n0.459022 0.691292 0.058732 F\n0.058732 0.459022 0.691292 F\n0.308708 0.941268 0.540978 F\n0.941268 0.540978 0.308708 F\n0.540978 0.308708 0.941268 F\n",
"nsites": 10,
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{
"id": "mp-998536",
"created_at": "2022-09-04T14:40:59.100986Z",
"structure_string": "Rb4 Ca4 Br12\n1.0\n4.419521 0.000000 0.000000\n0.000000 9.846748 0.000000\n0.000000 0.000000 16.384025\nRb Ca Br\n4 4 12\ndirect\n0.250000 0.569749 0.678723 Rb\n0.750000 0.430251 0.321277 Rb\n0.250000 0.069749 0.821277 Rb\n0.750000 0.930251 0.178723 Rb\n0.750000 0.669124 0.944669 Ca\n0.250000 0.330876 0.055331 Ca\n0.750000 0.169124 0.555331 Ca\n0.250000 0.830876 0.444669 Ca\n0.250000 0.832499 0.008792 Br\n0.750000 0.167501 0.991208 Br\n0.250000 0.332499 0.491208 Br\n0.750000 0.667501 0.508792 Br\n0.750000 0.518181 0.101143 Br\n0.250000 0.481819 0.898857 Br\n0.750000 0.018181 0.398857 Br\n0.250000 0.981819 0.601143 Br\n0.750000 0.790407 0.788501 Br\n0.250000 0.209593 0.211499 Br\n0.750000 0.290407 0.711499 Br\n0.250000 0.709593 0.288501 Br\n",
"nsites": 20,
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"elements": [
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"density": 3.4026710053883096,
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"formula_full": "Rb4 Ca4 Br12",
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"updated_at": "2021-11-28T01:35:11.308000Z",
"spacegroup": 62
},
{
"id": "mp-998535",
"created_at": "2022-09-04T14:47:39.154978Z",
"structure_string": "In1 Pb1 Cl3\n1.0\n4.031924 4.112962 0.000000\n-4.031924 4.112962 0.000000\n0.000000 0.023409 5.756954\nIn Pb Cl\n1 1 3\ndirect\n0.895736 0.895736 0.919182 In\n0.498881 0.498881 0.500285 Pb\n0.539531 0.539531 0.998321 Cl\n0.554893 0.001159 0.544964 Cl\n0.001159 0.554893 0.544964 Cl\n",
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},
{
"id": "mp-998527",
"created_at": "2022-09-04T14:40:32.425789Z",
"structure_string": "Ni2 Bi2 O6\n1.0\n-3.180566 4.484187 -0.000340\n-1.570170 -4.483890 2.766631\n1.776940 4.630649 3.051039\nNi Bi O\n2 2 6\ndirect\n0.492768 0.507188 0.521609 Ni\n0.995615 0.004412 0.013205 Ni\n0.697061 0.302979 0.908904 Bi\n0.208831 0.791071 0.373402 Bi\n0.772320 0.612854 0.732070 O\n0.108468 0.227703 0.732074 O\n0.387130 0.891563 0.732131 O\n0.851551 0.717386 0.219194 O\n0.282637 0.353404 0.219214 O\n0.646617 0.148437 0.219194 O\n",
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"spacegroup": 146
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{
"id": "mp-998525",
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"structure_string": "Ca1 Tc1 O3\n1.0\n2.781459 2.787520 0.000000\n-2.781459 2.787520 0.000000\n0.000000 0.013433 3.938687\nCa Tc O\n1 1 3\ndirect\n0.995082 0.995082 0.998347 Ca\n0.498210 0.498210 0.486799 Tc\n0.497044 0.998390 0.483413 O\n0.500773 0.500773 0.986287 O\n0.998390 0.497044 0.483413 O\n",
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{
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"created_at": "2022-09-04T14:43:17.642257Z",
"structure_string": "In2 Pb2 Cl6\n1.0\n2.148587 -7.008485 0.000000\n2.148587 7.008485 0.000000\n0.000000 0.000000 10.682042\nIn Pb Cl\n2 2 6\ndirect\n0.747551 0.252449 0.750000 In\n0.252449 0.747551 0.250000 In\n0.000000 0.000000 0.500000 Pb\n0.000000 0.000000 0.000000 Pb\n0.635953 0.364047 0.442918 Cl\n0.364047 0.635953 0.942918 Cl\n0.635953 0.364047 0.057082 Cl\n0.364047 0.635953 0.557082 Cl\n0.085673 0.914327 0.750000 Cl\n0.914327 0.085673 0.250000 Cl\n",
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{
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{
"id": "mp-998457",
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]
}