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{
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{
"id": "mp-1022940",
"created_at": "2022-09-04T14:39:37.456458Z",
"structure_string": "Mg12 Mn2 Bi2\n1.0\n5.168242 0.000000 0.000000\n0.000000 6.349730 0.000000\n0.000000 0.000000 11.007956\nMg Mn Bi\n12 2 2\ndirect\n0.500000 0.248433 0.416315 Mg\n0.500000 0.751567 0.416315 Mg\n0.000000 0.764433 0.082455 Mg\n0.000000 0.235567 0.082455 Mg\n0.000000 0.000000 0.328974 Mg\n0.000000 0.500000 0.338812 Mg\n0.500000 0.748433 0.916315 Mg\n0.500000 0.251567 0.916315 Mg\n0.000000 0.264433 0.582455 Mg\n0.000000 0.735567 0.582455 Mg\n0.000000 0.500000 0.828974 Mg\n0.000000 0.000000 0.838812 Mg\n0.500000 0.000000 0.166871 Mn\n0.500000 0.500000 0.666871 Mn\n0.500000 0.500000 0.167801 Bi\n0.500000 0.000000 0.667801 Bi\n",
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{
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"structure_string": "Mg1 Al4 H12 O12\n1.0\n-4.148666 2.630391 4.946145\n4.785708 -1.959090 5.752910\n4.088947 2.156671 -6.340248\nMg Al H O\n1 4 12 12\ndirect\n0.789872 0.119270 0.419899 Mg\n0.397860 0.815248 0.261056 Al\n0.545919 0.154780 0.709809 Al\n0.944959 0.670729 0.599101 Al\n0.042194 0.344854 0.347228 Al\n0.010565 0.032676 0.781770 H\n0.933654 0.990394 0.188206 H\n0.638707 0.499324 0.922884 H\n0.340189 0.442297 0.122851 H\n0.155554 0.703891 0.446417 H\n0.171399 0.437042 0.789673 H\n0.254152 0.142418 0.226036 H\n0.626170 0.827092 0.691524 H\n0.543274 0.745945 0.042147 H\n0.404202 0.229558 0.942314 H\n0.161957 0.248035 0.869843 H\n0.812744 0.591884 0.803696 H\n0.871363 0.906762 0.588990 O\n0.065923 0.093551 0.391667 O\n0.508519 0.415096 0.712186 O\n0.488360 0.581956 0.250942 O\n0.002904 0.604136 0.382689 O\n0.989789 0.420956 0.577837 O\n0.447401 0.088908 0.371147 O\n0.439081 0.866857 0.543727 O\n0.407214 0.819706 0.010803 O\n0.586565 0.208084 0.992303 O\n0.994365 0.234553 0.065440 O\n0.948829 0.708372 0.872494 O\n",
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],
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"volume": 232.3022268269204,
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"formula_full": "Mg1 Al4 H12 O12",
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"spacegroup": 1
},
{
"id": "mp-9025",
"created_at": "2022-09-04T14:39:36.721642Z",
"structure_string": "Y2 Si2 Au2\n1.0\n2.166230 -3.752020 0.000000\n2.166230 3.752020 0.000000\n0.000000 0.000000 7.657240\nY Si Au\n2 2 2\ndirect\n0.000000 0.000000 0.499500 Y\n0.000000 0.000000 0.999500 Y\n0.666667 0.333333 0.276231 Si\n0.333333 0.666667 0.776231 Si\n0.333333 0.666667 0.233269 Au\n0.666667 0.333333 0.733269 Au\n",
"nsites": 6,
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"elements": [
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"formula_full": "Y2 Si2 Au2",
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"spacegroup": 186
},
{
"id": "mp-546936",
"created_at": "2022-09-04T14:39:36.723064Z",
"structure_string": "Co2 Rh4 O8\n1.0\n0.000009 -0.000003 6.102319\n5.284737 -0.000023 -3.051158\n1.761616 4.982498 3.051156\nCo Rh O\n2 4 8\ndirect\n0.749999 0.874999 0.875000 Co\n0.250000 0.125002 0.124999 Co\n0.499987 0.500007 0.500007 Rh\n0.000014 0.500007 0.999978 Rh\n0.000015 0.500007 0.500009 Rh\n0.499984 0.999978 0.500008 Rh\n0.480304 0.740153 0.740151 O\n0.480304 0.740153 0.279544 O\n0.019695 0.740151 0.740153 O\n0.980251 0.259874 0.259874 O\n0.519751 0.259877 0.259875 O\n0.019698 0.279544 0.740151 O\n0.519750 0.259875 0.720375 O\n0.980250 0.720375 0.259876 O\n",
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"density": 6.7946545897058845,
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"volume": 160.68177895275113,
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"formula_full": "Co2 Rh4 O8",
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{
"id": "mp-559608",
"created_at": "2022-09-04T14:39:36.724433Z",
"structure_string": "K12 Nd4 Si28 O68\n1.0\n8.183876 -14.174890 0.000000\n8.183876 14.174890 0.000000\n0.000000 0.000000 7.279780\nK Nd Si O\n12 4 28 68\ndirect\n0.366113 0.904727 0.467751 K\n0.242974 0.003964 0.122201 K\n0.757026 0.996036 0.877799 K\n0.904727 0.538614 0.532249 K\n0.239010 0.242974 0.877799 K\n0.760990 0.757026 0.122201 K\n0.996036 0.239010 0.122201 K\n0.095273 0.461386 0.467751 K\n0.633887 0.095273 0.532249 K\n0.538614 0.633887 0.467751 K\n0.461386 0.366113 0.532249 K\n0.003964 0.760990 0.877799 K\n0.000000 0.000000 0.000000 Nd\n0.000000 0.500000 0.000000 Nd\n0.500000 0.000000 0.000000 Nd\n0.500000 0.500000 0.000000 Nd\n0.619610 0.906400 0.301694 Si\n0.748261 0.208727 0.978929 Si\n0.208727 0.460466 0.021071 Si\n0.093600 0.713210 0.301694 Si\n0.713210 0.619610 0.698306 Si\n0.539534 0.748261 0.021071 Si\n0.692925 0.525681 0.325765 Si\n0.307075 0.474319 0.674235 Si\n0.991910 0.156054 0.621821 Si\n0.791273 0.539534 0.978929 Si\n0.333333 0.666667 0.133430 Si\n0.525681 0.832756 0.674235 Si\n0.286790 0.380390 0.301694 Si\n0.666667 0.333333 0.423836 Si\n0.843946 0.835856 0.621821 Si\n0.835856 0.991910 0.378179 Si\n0.167244 0.692925 0.674235 Si\n0.156054 0.164144 0.378179 Si\n0.460466 0.251739 0.978929 Si\n0.333333 0.666667 0.576164 Si\n0.832756 0.307075 0.325765 Si\n0.474319 0.167244 0.325765 Si\n0.251739 0.791273 0.021071 Si\n0.906400 0.286790 0.698306 Si\n0.666667 0.333333 0.866570 Si\n0.380390 0.093600 0.698306 Si\n0.164144 0.008090 0.621821 Si\n0.008090 0.843946 0.378179 Si\n0.590763 0.228036 0.352873 O\n0.374940 0.156253 0.873381 O\n0.362727 0.590763 0.647127 O\n0.070399 0.181421 0.456256 O\n0.251318 0.270157 0.362053 O\n0.744683 0.306164 0.935663 O\n0.343752 0.885126 0.081846 O\n0.571055 0.830645 0.472713 O\n0.018839 0.748682 0.362053 O\n0.818579 0.888978 0.456256 O\n0.114874 0.458626 0.081846 O\n0.255317 0.693836 0.064337 O\n0.843747 0.218687 0.873381 O\n0.110734 0.980482 0.816386 O\n0.933147 0.378693 0.240753 O\n0.561481 0.255317 0.935663 O\n0.559249 0.770630 0.799674 O\n0.440751 0.229370 0.200326 O\n0.929601 0.818579 0.543744 O\n0.869748 0.889266 0.816386 O\n0.211381 0.440751 0.799674 O\n0.039392 0.603170 0.255503 O\n0.270157 0.018839 0.637947 O\n0.111022 0.929601 0.456256 O\n0.445546 0.066853 0.240753 O\n0.788619 0.559249 0.200326 O\n0.656248 0.114874 0.918154 O\n0.771964 0.362727 0.352873 O\n0.889266 0.019518 0.183614 O\n0.740410 0.571055 0.527287 O\n0.436222 0.039392 0.744497 O\n0.306164 0.561481 0.064337 O\n0.458626 0.343752 0.918154 O\n0.428945 0.169355 0.527287 O\n0.228036 0.637273 0.647127 O\n0.830645 0.259590 0.527287 O\n0.066853 0.621307 0.759247 O\n0.960608 0.396830 0.744497 O\n0.229370 0.788619 0.799674 O\n0.554454 0.933147 0.759247 O\n0.218687 0.374940 0.126619 O\n0.181421 0.111022 0.543744 O\n0.169355 0.740410 0.472713 O\n0.637273 0.409237 0.352873 O\n0.980482 0.869748 0.183614 O\n0.541374 0.656248 0.081846 O\n0.259590 0.428945 0.472713 O\n0.396830 0.436222 0.255503 O\n0.019518 0.130252 0.816386 O\n0.885126 0.541374 0.918154 O\n0.729843 0.981161 0.362053 O\n0.770630 0.211381 0.200326 O\n0.378693 0.445546 0.759247 O\n0.438519 0.744683 0.064337 O\n0.333333 0.666667 0.355231 O\n0.409237 0.771964 0.647127 O\n0.156253 0.781313 0.126619 O\n0.781313 0.625060 0.873381 O\n0.130252 0.110734 0.183614 O\n0.563778 0.960608 0.255503 O\n0.666667 0.333333 0.644769 O\n0.621307 0.554454 0.240753 O\n0.625060 0.843747 0.126619 O\n0.693836 0.438519 0.935663 O\n0.981161 0.251318 0.637947 O\n0.888978 0.070399 0.543744 O\n0.603170 0.563778 0.744497 O\n0.748682 0.729843 0.637947 O\n",
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{
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"structure_string": "Ba2 Mn2 Sb4\n1.0\n-2.243418 2.243418 12.355266\n2.243418 -2.243418 12.355266\n2.243418 2.243418 -12.355266\nBa Mn Sb\n2 2 4\ndirect\n0.885258 0.885258 0.000000 Ba\n0.114742 0.114742 0.000000 Ba\n0.250000 0.750000 0.500000 Mn\n0.750000 0.250000 0.500000 Mn\n0.685328 0.685328 0.000000 Sb\n0.314672 0.314672 0.000000 Sb\n0.000000 0.500000 0.500000 Sb\n0.500000 0.000000 0.500000 Sb\n",
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{
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