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{
"id": "jvasp-8233",
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{
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{
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"updated_at": "2022-09-04T14:37:28.970034Z",
"structure_string": "Ca4 Mg3 H14\n1.0\n3.112170 -5.390437 0.000000\n3.112170 5.390437 0.000000\n0.000000 0.000000 6.842828\nCa Mg H\n4 3 14\ndirect\n0.000000 0.000000 0.266422 Ca\n0.000000 0.000000 0.733578 Ca\n0.666667 0.333333 0.500000 Ca\n0.333333 0.666667 0.500000 Ca\n0.557060 0.557060 0.000000 Mg\n-0.000000 0.442940 0.000000 Mg\n0.442940 -0.000000 0.000000 Mg\n0.769441 -0.000000 0.000000 H\n-0.000000 0.769441 0.000000 H\n0.230560 0.230560 0.000000 H\n0.736431 -0.000000 0.500000 H\n-0.000000 0.736431 0.500000 H\n0.263569 0.263569 0.500000 H\n0.611972 0.611972 0.723981 H\n-0.000000 0.388028 0.723981 H\n0.666667 0.333333 0.000000 H\n0.388028 -0.000000 0.276019 H\n-0.000000 0.388028 0.276019 H\n0.611972 0.611972 0.276019 H\n0.388028 -0.000000 0.723981 H\n0.333333 0.666667 0.000000 H\n",
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{
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"structure_string": "Li2 Ni1 Bi1 O4\n1.0\n-5.420200 0.316912 0.000000\n-1.666501 2.664579 3.142803\n-1.666501 2.664579 -3.142803\nLi Ni Bi O\n2 1 1 4\ndirect\n0.500000 0.750000 0.250000 Li\n-0.000000 0.500000 0.500000 Li\n0.500000 0.250000 0.750000 Ni\n0.000000 0.000000 0.000000 Bi\n0.935290 0.032355 0.532355 O\n0.519970 0.740015 0.740015 O\n0.480030 0.259985 0.259985 O\n0.064710 0.467645 0.967645 O\n",
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{
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"structure_string": "Be2 V1 Ru1\n1.0\n2.460363 -3.093667 0.000000\n2.460363 3.093667 0.000000\n0.000000 0.000000 2.872594\nBe V Ru\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.499999 0.499999 0.000000 Be\n-0.000001 0.500000 0.499999 V\n0.500000 -0.000001 0.499999 Ru\n",
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{
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"structure_string": "Ti5 Nb1 O12\n1.0\n-4.668105 4.668105 2.997489\n0.010920 4.678158 -2.996125\n-4.678158 -0.010920 -2.996125\nTi Nb O\n5 1 12\ndirect\n0.836936 0.661313 0.661313 Ti\n0.674306 0.337811 0.337811 Ti\n0.325696 0.662189 0.662189 Ti\n0.163066 0.338687 0.338687 Ti\n0.000000 0.000000 0.000000 Ti\n0.500000 0.000000 0.000000 Nb\n0.669796 0.631225 0.029210 O\n0.000001 0.303860 0.696139 O\n0.371238 0.433628 0.433628 O\n0.033748 0.768963 0.768963 O\n0.704954 0.102421 0.102421 O\n0.966254 0.231036 0.231036 O\n0.295048 0.897579 0.897579 O\n0.330206 0.970789 0.368775 O\n0.330206 0.368775 0.970789 O\n0.669796 0.029210 0.631225 O\n0.628764 0.566371 0.566371 O\n0.000001 0.696139 0.303860 O\n",
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{
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"updated_at": "2022-09-04T14:38:46.042850Z",
"structure_string": "Na2 Cd2 Rh8 O16\n1.0\n3.087859 -0.000000 0.000000\n0.000000 9.101029 0.065857\n-0.000000 -0.013475 10.890796\nNa Cd Rh O\n2 2 8 16\ndirect\n0.250000 0.734946 0.842160 Na\n0.750000 0.265055 0.157841 Na\n0.250000 0.236507 0.660922 Cd\n0.750000 0.763494 0.339079 Cd\n0.750000 0.410426 0.901557 Rh\n0.750000 0.908213 0.601326 Rh\n0.250000 0.091788 0.398674 Rh\n0.250000 0.589575 0.098444 Rh\n0.750000 0.949297 0.115704 Rh\n0.250000 0.557336 0.617809 Rh\n0.250000 0.050703 0.884297 Rh\n0.750000 0.442665 0.382191 Rh\n0.250000 0.385501 0.024529 O\n0.250000 0.804465 0.163297 O\n0.250000 0.305652 0.336205 O\n0.750000 0.116797 0.526987 O\n0.750000 0.614499 0.975472 O\n0.250000 0.883204 0.473014 O\n0.750000 0.548484 0.214340 O\n0.250000 0.586216 0.430520 O\n0.250000 0.451517 0.785660 O\n0.250000 0.968522 0.708928 O\n0.750000 0.413785 0.569481 O\n0.750000 0.914720 0.931456 O\n0.750000 0.694348 0.663796 O\n0.250000 0.085281 0.068545 O\n0.750000 0.031478 0.291073 O\n0.750000 0.195536 0.836703 O\n",
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"structure_string": "Pr2 Al2 O6\n1.0\n4.642904 -0.014599 2.654076\n1.533097 4.382509 2.654076\n-0.020642 -0.014599 5.347920\nPr Al O\n2 2 6\ndirect\n0.750000 0.750000 0.750001 Pr\n0.250000 0.250000 0.250000 Pr\n0.500000 0.500000 0.500001 Al\n0.000000 0.000000 0.000000 Al\n0.294854 0.750000 0.205147 O\n0.750000 0.205146 0.294855 O\n0.205147 0.294854 0.750000 O\n0.705146 0.250000 0.794854 O\n0.794854 0.705146 0.250001 O\n0.250001 0.794854 0.705147 O\n",
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]
}