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{
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{
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"structure_string": "Ga4 I12\n1.0\n0.000000 9.606395 -0.072405\n6.000259 0.000000 0.000000\n0.000000 -3.659689 -11.223707\nGa I\n4 12\ndirect\n0.699372 0.001336 0.049244 Ga\n0.300629 0.501336 0.450756 Ga\n0.300629 0.998664 0.950757 Ga\n0.699372 0.498664 0.549244 Ga\n0.834008 0.743911 0.215026 I\n0.165992 0.243911 0.284975 I\n0.165992 0.256090 0.784975 I\n0.834009 0.756090 0.715026 I\n0.832910 0.258828 0.948968 I\n0.167091 0.758828 0.551033 I\n0.167091 0.741172 0.051033 I\n0.832910 0.241172 0.448968 I\n0.500644 0.765717 0.879060 I\n0.499357 0.265717 0.620941 I\n0.499357 0.234283 0.120941 I\n0.500644 0.734283 0.379060 I\n",
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{
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"structure_string": "Nd12 Nb4 O28\n1.0\n7.663464 0.000000 0.000000\n0.000000 7.691680 0.000000\n0.000000 0.000000 11.008165\nNd Nb O\n12 4 28\ndirect\n0.487590 0.290434 0.250000 Nd\n0.749253 0.546586 0.475322 Nd\n0.250746 0.453414 0.524677 Nd\n0.987590 0.209565 0.250000 Nd\n0.750746 0.046586 0.975322 Nd\n0.750746 0.046586 0.524677 Nd\n0.512409 0.709565 0.750000 Nd\n0.250746 0.453414 0.975322 Nd\n0.012409 0.790434 0.750000 Nd\n0.249254 0.953414 0.024678 Nd\n0.749253 0.546586 0.024678 Nd\n0.249254 0.953414 0.475322 Nd\n0.504074 0.247309 0.750000 Nb\n0.004075 0.252691 0.750000 Nb\n0.495925 0.752691 0.250000 Nb\n0.995925 0.747309 0.250000 Nb\n0.247299 0.333504 0.750000 O\n0.044739 0.591510 0.386391 O\n0.538010 0.449533 0.873360 O\n0.256514 0.727128 0.882255 O\n0.756513 0.772872 0.882255 O\n0.461989 0.550467 0.126640 O\n0.747298 0.166496 0.750000 O\n0.544739 0.908490 0.113609 O\n0.243486 0.227128 0.117745 O\n0.955260 0.408490 0.613608 O\n0.044739 0.591510 0.113609 O\n0.544739 0.908490 0.386391 O\n0.955260 0.408490 0.886391 O\n0.256514 0.727128 0.617744 O\n0.455261 0.091510 0.886391 O\n0.743486 0.272872 0.117745 O\n0.455261 0.091510 0.613608 O\n0.243486 0.227128 0.382255 O\n0.461989 0.550467 0.373360 O\n0.252701 0.833504 0.250000 O\n0.756513 0.772872 0.617744 O\n0.961989 0.949533 0.373360 O\n0.538010 0.449533 0.626640 O\n0.752701 0.666496 0.250000 O\n0.961989 0.949533 0.126640 O\n0.038011 0.050467 0.626640 O\n0.743486 0.272872 0.382255 O\n0.038011 0.050467 0.873360 O\n",
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{
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"structure_string": "Li4 U2 I12\n1.0\n7.364740 -0.000000 0.000000\n-3.682370 6.378052 -0.000000\n0.000000 0.000000 13.816631\nLi U I\n4 2 12\ndirect\n0.666667 0.333333 0.250000 Li\n0.333333 0.666667 0.750000 Li\n0.000000 0.000000 0.250000 Li\n0.000000 0.000000 0.750000 Li\n0.666667 0.333333 0.750000 U\n0.333333 0.666667 0.250000 U\n-0.001804 0.331415 0.124762 I\n0.001803 0.668584 0.875238 I\n0.668584 0.666781 0.124762 I\n0.331415 0.333219 0.875238 I\n-0.001804 0.666781 0.375238 I\n0.666781 0.668584 0.624762 I\n0.666781 -0.001804 0.875238 I\n0.668585 0.001804 0.375238 I\n0.001803 0.333219 0.624762 I\n0.333219 0.001804 0.124762 I\n0.333219 0.331415 0.375238 I\n0.331415 -0.001804 0.624762 I\n",
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{
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"created_at": "2022-09-04T14:37:54.959056Z",
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"structure_string": "Dy8 Ti12 Si16\n1.0\n7.070342 0.000000 0.000000\n-0.000000 7.070342 0.000000\n0.000000 -0.000000 12.983065\nDy Ti Si\n8 12 16\ndirect\n0.998128 0.659856 0.033063 Dy\n0.001871 0.340144 0.533063 Dy\n0.659856 0.998128 0.966937 Dy\n0.159856 0.501871 0.783064 Dy\n0.840144 0.498129 0.283063 Dy\n0.501871 0.159856 0.216937 Dy\n0.498129 0.840144 0.716937 Dy\n0.340144 0.001871 0.466937 Dy\n0.653315 0.492404 0.873881 Ti\n0.492404 0.653315 0.126119 Ti\n0.172276 0.827723 0.250000 Ti\n0.827723 0.172276 0.750000 Ti\n0.672276 0.672276 0.500000 Ti\n0.327723 0.327723 0.000000 Ti\n0.507596 0.346685 0.626119 Ti\n0.992404 0.846685 0.623881 Ti\n0.007596 0.153315 0.123881 Ti\n0.846685 0.992404 0.376119 Ti\n0.346685 0.507596 0.373881 Ti\n0.153315 0.007596 0.876119 Ti\n0.129819 0.202160 0.316413 Si\n0.370181 0.702160 0.933588 Si\n0.629819 0.297840 0.433588 Si\n0.702160 0.370181 0.066413 Si\n0.297840 0.629819 0.566413 Si\n0.797839 0.870181 0.183588 Si\n0.290739 0.954775 0.065007 Si\n0.790738 0.545225 0.684994 Si\n0.454775 0.209261 0.815007 Si\n0.209261 0.454775 0.184994 Si\n0.709261 0.045225 0.565007 Si\n0.954775 0.290739 0.934994 Si\n0.045225 0.709261 0.434994 Si\n0.202160 0.129819 0.683588 Si\n0.545225 0.790738 0.315007 Si\n0.870181 0.797839 0.816413 Si\n",
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"structure_string": "Na16 Ti2 As8\n1.0\n8.416354 -0.000000 4.859184\n2.805452 7.935015 4.859184\n-0.000000 -0.000000 9.718368\nNa Ti As\n16 2 8\ndirect\n-0.000000 0.500000 -0.000000 Na\n0.155647 0.155647 0.594353 Na\n0.155647 0.594353 0.155647 Na\n0.594353 0.155647 0.594353 Na\n0.594353 0.155647 0.155647 Na\n0.405647 0.405647 0.844353 Na\n0.844353 0.405647 0.405647 Na\n0.405647 0.844352 0.405647 Na\n0.155647 0.594353 0.594353 Na\n0.405647 0.844352 0.844353 Na\n0.594353 0.594353 0.155647 Na\n0.844353 0.844352 0.405647 Na\n0.844353 0.405647 0.844353 Na\n0.000000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 Na\n0.500000 0.000000 -0.000000 Na\n0.875000 0.875000 0.875000 Ti\n0.125000 0.125000 0.125000 Ti\n0.230374 0.230374 0.808878 As\n0.230374 0.808878 0.230374 As\n0.808878 0.230374 0.230374 As\n0.769625 0.191122 0.769626 As\n0.191122 0.769625 0.769626 As\n0.769625 0.769625 0.191122 As\n0.230374 0.230374 0.230374 As\n0.769625 0.769625 0.769626 As\n",
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"structure_string": "Dy8 Br16\n1.0\n6.635516 0.000000 0.000000\n-0.000000 7.608340 0.000000\n0.000000 0.000000 12.858474\nDy Br\n8 16\ndirect\n0.675066 0.048662 0.096308 Dy\n0.175066 0.951338 0.403692 Dy\n0.824935 0.548661 0.903692 Dy\n0.324934 0.451338 0.596307 Dy\n0.324934 0.951338 0.903692 Dy\n0.824935 0.048662 0.596307 Dy\n0.175066 0.451338 0.096308 Dy\n0.675066 0.548661 0.403692 Dy\n0.702975 0.380899 0.704889 Br\n0.202975 0.619101 0.795110 Br\n0.202975 0.119101 0.704889 Br\n0.702975 0.880899 0.795110 Br\n0.297025 0.619101 0.295111 Br\n0.797026 0.380899 0.204889 Br\n0.019497 0.296233 0.453598 Br\n0.980503 0.703767 0.546402 Br\n0.480503 0.796233 0.546402 Br\n0.980503 0.203767 0.953597 Br\n0.297025 0.119101 0.204889 Br\n0.480503 0.296233 0.953597 Br\n0.519498 0.203767 0.453598 Br\n0.019497 0.796233 0.046402 Br\n0.519498 0.703767 0.046402 Br\n0.797026 0.880899 0.295111 Br\n",
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{
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"structure_string": "Dy8 Br16\n1.0\n6.635577 0.000000 0.000000\n0.000000 7.608541 0.000000\n0.000000 0.000000 12.858046\nDy Br\n8 16\ndirect\n0.675083 0.048668 0.096296 Dy\n0.175083 0.951332 0.403704 Dy\n0.824918 0.548668 0.903704 Dy\n0.324917 0.451332 0.596297 Dy\n0.324917 0.951332 0.903704 Dy\n0.824918 0.048668 0.596297 Dy\n0.175083 0.451332 0.096296 Dy\n0.675083 0.548668 0.403704 Dy\n0.702930 0.380852 0.704888 Br\n0.202930 0.619148 0.795112 Br\n0.202930 0.119148 0.704888 Br\n0.702930 0.880852 0.795112 Br\n0.297070 0.619148 0.295112 Br\n0.797070 0.380852 0.204888 Br\n0.019538 0.296248 0.453570 Br\n0.980462 0.703752 0.546430 Br\n0.480462 0.796247 0.546430 Br\n0.980462 0.203752 0.953570 Br\n0.297070 0.119148 0.204888 Br\n0.480462 0.296248 0.953570 Br\n0.519538 0.203752 0.453570 Br\n0.019538 0.796247 0.046430 Br\n0.519538 0.703752 0.046430 Br\n0.797070 0.880852 0.295112 Br\n",
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{
"id": "jvasp-22856",
"created_at": "2022-09-04T14:37:32.173520Z",
"updated_at": "2022-09-04T14:37:32.173539Z",
"structure_string": "Be6 Cd8 Si6 Te2 O24\n1.0\n8.659008 -0.000000 -0.000000\n0.000000 8.659008 0.000000\n-0.000000 -0.000000 8.659008\nBe Cd Si Te O\n6 8 6 2 24\ndirect\n0.250000 0.500000 0.000000 Be\n0.500000 0.000000 0.750000 Be\n0.500000 0.000000 0.250000 Be\n0.000000 0.250000 0.500000 Be\n0.000000 0.750000 0.500000 Be\n0.750000 0.500000 0.000000 Be\n0.684066 0.684066 0.684066 Cd\n0.815934 0.184066 0.815934 Cd\n0.184066 0.815934 0.815934 Cd\n0.815934 0.815934 0.184066 Cd\n0.315934 0.315934 0.684066 Cd\n0.315934 0.684066 0.315934 Cd\n0.184066 0.184066 0.184066 Cd\n0.684066 0.315934 0.315934 Cd\n0.000000 0.500000 0.750000 Si\n0.250000 0.000000 0.500000 Si\n0.000000 0.500000 0.250000 Si\n0.500000 0.250000 0.000000 Si\n0.500000 0.750000 0.000000 Si\n0.750000 0.000000 0.500000 Si\n0.000000 0.000000 0.000000 Te\n0.500000 0.500000 0.500000 Te\n0.354126 0.645744 0.063707 O\n0.354256 0.063707 0.645874 O\n0.063707 0.354126 0.645744 O\n0.063707 0.645874 0.354256 O\n0.645744 0.936294 0.645874 O\n0.936294 0.645874 0.645744 O\n0.645744 0.063707 0.354126 O\n0.354256 0.936294 0.354126 O\n0.936294 0.354126 0.354256 O\n0.145744 0.854126 0.563707 O\n0.854256 0.145874 0.563707 O\n0.854126 0.436294 0.854256 O\n0.563707 0.145744 0.854126 O\n0.145874 0.563707 0.854256 O\n0.145874 0.436294 0.145744 O\n0.354126 0.354256 0.936294 O\n0.145744 0.145874 0.436294 O\n0.854256 0.854126 0.436294 O\n0.563707 0.854256 0.145874 O\n0.436294 0.854256 0.854126 O\n0.854126 0.563707 0.145744 O\n0.645874 0.354256 0.063707 O\n0.436294 0.145744 0.145874 O\n0.645874 0.645744 0.936294 O\n",
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