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{
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{
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{
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"structure_string": "Na4 Ti2 Si8 O22\n1.0\n-5.443102 5.443102 3.950677\n5.443102 -5.443102 3.950677\n5.443102 5.443102 -3.950677\nNa Ti Si O\n4 2 8 22\ndirect\n0.366140 0.317416 0.683556 Na\n0.317416 0.633860 0.951276 Na\n0.633860 0.682584 0.316444 Na\n0.682584 0.366140 0.048724 Na\n0.756223 0.756223 0.000000 Ti\n0.243777 0.243777 0.000000 Ti\n0.498963 0.795372 0.679326 Si\n0.501037 0.204628 0.320674 Si\n0.204628 0.883953 0.703591 Si\n0.883953 0.180363 0.679326 Si\n0.180363 0.501037 0.296409 Si\n0.819637 0.498963 0.703591 Si\n0.116047 0.819637 0.320674 Si\n0.795372 0.116047 0.296409 Si\n0.553949 0.681921 0.773021 O\n0.408281 0.677591 0.466394 O\n0.446051 0.318079 0.226979 O\n0.058112 0.591719 0.269310 O\n0.219072 0.446051 0.127972 O\n0.303931 0.957863 0.261794 O\n0.780928 0.553949 0.872028 O\n0.318079 0.091100 0.872028 O\n0.677591 0.211198 0.269310 O\n0.322409 0.788802 0.730690 O\n0.696069 0.042137 0.738206 O\n0.042137 0.303931 0.346068 O\n0.500000 0.500000 0.000000 O\n0.788802 0.058112 0.466394 O\n0.211198 0.941888 0.533606 O\n0.908900 0.780928 0.226979 O\n0.091100 0.219072 0.773021 O\n0.957863 0.696069 0.653932 O\n0.681921 0.908900 0.127972 O\n0.591719 0.322409 0.533606 O\n0.000000 0.000000 0.000000 O\n0.941888 0.408281 0.730690 O\n",
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{
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{
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"structure_string": "Al2 Cu3 O6\n1.0\n1.440373 5.713200 0.000000\n-1.440373 5.713200 0.000000\n0.000000 4.505220 7.595049\nAl Cu O\n2 3 6\ndirect\n0.334393 0.334393 0.827445 Al\n0.665607 0.665607 0.172555 Al\n0.000000 0.000000 0.000000 Cu\n0.664634 0.664634 0.670668 Cu\n0.335366 0.335366 0.329332 Cu\n0.794667 0.794667 0.726124 O\n0.481424 0.481424 0.343044 O\n0.145476 0.145476 0.036718 O\n0.854524 0.854524 0.963282 O\n0.518576 0.518576 0.656956 O\n0.205333 0.205333 0.273876 O\n",
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{
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{
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"structure_string": "Pr4 Mg2 Cu4\n1.0\n7.916992 0.000000 0.000000\n0.000000 7.916992 0.000000\n0.000000 0.000000 3.807477\nPr Mg Cu\n4 2 4\ndirect\n0.677955 0.177955 0.500000 Pr\n0.322045 0.822045 0.500000 Pr\n0.177955 0.322045 0.500000 Pr\n0.822045 0.677955 0.500000 Pr\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.116447 0.616447 0.000000 Cu\n0.883553 0.383553 0.000000 Cu\n0.616447 0.883553 0.000000 Cu\n0.383553 0.116447 0.000000 Cu\n",
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"spacegroup": 127
}
]
}