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{
"id": "jvasp-98355",
"created_at": "2022-09-04T14:35:49.538261Z",
"updated_at": "2022-09-04T14:35:49.538287Z",
"structure_string": "Ba4 Al16 O28\n1.0\n12.860491 0.000000 0.000000\n0.000000 9.239364 0.000000\n0.000000 0.000000 5.586442\nBa Al O\n4 16 28\ndirect\n0.000000 0.191220 0.884637 Ba\n0.500000 0.691220 0.115362 Ba\n0.000000 0.782737 0.384648 Ba\n0.500000 0.282737 0.615351 Ba\n0.123141 0.551755 0.879100 Al\n0.876859 0.551755 0.879100 Al\n0.376859 0.051755 0.120899 Al\n0.123143 0.422205 0.379101 Al\n0.876857 0.422205 0.379101 Al\n0.376857 0.922205 0.620899 Al\n0.623143 0.922205 0.620899 Al\n0.623140 0.051755 0.120899 Al\n0.674939 0.398747 0.067834 Al\n0.174939 0.898746 0.932165 Al\n0.825061 0.898746 0.932165 Al\n0.325057 0.575220 0.567833 Al\n0.674943 0.575220 0.567833 Al\n0.174943 0.075220 0.432167 Al\n0.825057 0.075220 0.432167 Al\n0.325061 0.398747 0.067834 Al\n0.373916 0.461995 0.341577 O\n0.873913 0.011973 0.158428 O\n0.126087 0.011973 0.158428 O\n0.626087 0.511972 0.841572 O\n0.373913 0.511972 0.841572 O\n0.133329 0.724136 0.997495 O\n0.366671 0.224136 0.002505 O\n0.866671 0.724136 0.997495 O\n0.500000 0.988183 0.198605 O\n0.000000 0.488183 0.801395 O\n0.626084 0.461995 0.341577 O\n0.633329 0.224136 0.002505 O\n0.126084 0.961994 0.658422 O\n0.185331 0.425571 0.083553 O\n0.366662 0.749828 0.502499 O\n0.633338 0.749828 0.502499 O\n0.133338 0.249828 0.497500 O\n0.866662 0.249828 0.497500 O\n0.185328 0.548391 0.583555 O\n0.814672 0.548391 0.583555 O\n0.314672 0.048391 0.416445 O\n0.685328 0.048391 0.416445 O\n0.500000 0.985760 0.698600 O\n0.814669 0.425571 0.083553 O\n0.314669 0.925571 0.916447 O\n0.685331 0.925571 0.916447 O\n0.873915 0.961994 0.658422 O\n0.000000 0.485761 0.301399 O\n",
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{
"id": "jvasp-17332",
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"structure_string": "Y1 Bi1 O3\n1.0\n4.405177 -0.000000 0.000000\n-0.000000 4.405177 0.000000\n-0.000000 -0.000000 4.405177\nY Bi O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 Bi\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n",
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{
"id": "jvasp-91867",
"created_at": "2022-09-04T14:35:49.534461Z",
"updated_at": "2022-09-04T14:35:49.534483Z",
"structure_string": "Hf1 Mg7\n1.0\n6.400371 0.000000 0.000000\n-3.200185 5.542883 -0.000000\n-0.000000 0.000000 5.045035\nHf Mg\n1 7\ndirect\n0.166667 0.333333 0.250000 Hf\n0.170257 0.835128 0.250000 Mg\n0.664871 0.329742 0.250000 Mg\n0.664871 0.835128 0.250000 Mg\n0.329191 0.170809 0.750001 Mg\n0.329191 0.658382 0.750001 Mg\n0.841617 0.170809 0.750001 Mg\n0.833332 0.666667 0.750001 Mg\n",
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{
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"updated_at": "2022-09-04T14:35:49.533330Z",
"structure_string": "Ti1 Be2 Pt1\n1.0\n2.829084 -0.000000 -0.000000\n-0.000000 2.829084 -0.000000\n0.000000 0.000000 6.110117\nTi Be Pt\n1 2 1\ndirect\n0.499999 0.499999 0.500000 Ti\n0.000000 0.000000 0.782505 Be\n0.000000 0.000000 0.217495 Be\n0.499999 0.499999 0.000000 Pt\n",
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{
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"updated_at": "2022-09-04T14:35:49.532150Z",
"structure_string": "Pr5 Ru2 O12\n1.0\n6.009271 0.000000 0.000000\n-3.004635 6.149259 -1.930739\n0.000000 -0.002249 7.718655\nPr Ru O\n5 2 12\ndirect\n0.306889 0.613780 0.643176 Pr\n0.693110 0.386220 0.356825 Pr\n0.690592 0.381185 0.832724 Pr\n0.309407 0.618816 0.167277 Pr\n-0.000000 -0.000000 0.500000 Pr\n0.764973 0.000000 0.000000 Ru\n0.235027 0.000000 0.000000 Ru\n0.587229 0.683338 0.922034 O\n0.500124 0.000249 0.169825 O\n0.594840 0.690880 0.422614 O\n0.000899 0.001800 0.184372 O\n0.903959 0.309120 0.577387 O\n0.405159 0.309120 0.577387 O\n0.499875 0.999751 0.830175 O\n0.412771 0.316662 0.077967 O\n0.999100 0.998200 0.815628 O\n0.096040 0.690880 0.422614 O\n0.096108 0.683338 0.922034 O\n0.903891 0.316662 0.077967 O\n",
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"updated_at": "2022-09-04T14:35:49.526655Z",
"structure_string": "Ba2 Cu2 Sn4\n1.0\n4.707330 0.000000 -0.000000\n0.000000 4.716230 -1.150124\n-0.000000 -0.045302 10.059043\nBa Cu Sn\n2 2 4\ndirect\n0.250000 0.607796 0.215591 Ba\n0.750000 0.392205 0.784409 Ba\n0.750000 0.179454 0.358908 Cu\n0.250000 0.820547 0.641092 Cu\n0.250000 0.956632 0.913264 Sn\n0.750000 0.043369 0.086736 Sn\n0.750000 0.750320 0.500640 Sn\n0.250000 0.249680 0.499360 Sn\n",
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{
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"created_at": "2022-09-04T14:35:49.525453Z",
"updated_at": "2022-09-04T14:35:49.525480Z",
"structure_string": "Ba2 Fe2 Si8 O20\n1.0\n7.649498 -0.000013 -0.000022\n-0.000013 7.649516 -0.000014\n-0.000022 -0.000014 7.974351\nBa Fe Si O\n2 2 8 20\ndirect\n0.250000 0.750001 0.000001 Ba\n0.750000 0.250000 0.000000 Ba\n0.750000 0.750001 0.829142 Fe\n0.250001 0.250000 0.170859 Fe\n0.541245 0.958756 0.304057 Si\n0.458755 0.041245 0.695943 Si\n0.041244 0.458757 0.695945 Si\n0.041244 0.041244 0.695944 Si\n0.958757 0.958757 0.304056 Si\n0.458756 0.458757 0.695944 Si\n0.541245 0.541244 0.304057 Si\n0.958757 0.541244 0.304056 Si\n0.998710 0.750001 0.269702 O\n0.932391 0.932393 0.831563 O\n0.000001 0.000001 0.500000 O\n0.567611 0.567611 0.831562 O\n0.498712 0.250001 0.730301 O\n0.500000 0.000001 0.500000 O\n0.250001 0.498713 0.730300 O\n0.432391 0.432390 0.168437 O\n0.750000 0.501288 0.269701 O\n0.001291 0.250001 0.730300 O\n0.432391 0.067609 0.168438 O\n0.567610 0.932392 0.831562 O\n0.067610 0.432391 0.168438 O\n0.501289 0.750000 0.269700 O\n0.000000 0.500001 0.500001 O\n0.932391 0.567610 0.831563 O\n0.750001 0.998712 0.269701 O\n0.067610 0.067608 0.168436 O\n0.250000 0.001290 0.730300 O\n0.500000 0.500000 0.500000 O\n",
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"structure_string": "K2 Li1 Au1 Cl6\n1.0\n6.097345 -0.000000 3.520304\n2.032448 5.748632 3.520304\n0.000000 -0.000000 7.040608\nK Li Au Cl\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.499999 Li\n0.000000 0.000000 0.000000 Au\n0.749149 0.250851 0.250851 Cl\n0.250852 0.250851 0.749148 Cl\n0.250852 0.749148 0.749148 Cl\n0.250852 0.749148 0.250851 Cl\n0.749149 0.250851 0.749148 Cl\n0.749149 0.749148 0.250850 Cl\n",
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"structure_string": "Na1 Mg2 Be1\n1.0\n-2.383685 2.383685 3.371404\n2.383685 -2.383685 3.371404\n2.383685 2.383685 -3.371404\nNa Mg Be\n1 2 1\ndirect\n0.250000 0.750001 0.500001 Na\n0.000000 0.000000 0.000000 Mg\n0.499999 0.499999 0.000000 Mg\n0.750001 0.250000 0.500001 Be\n",
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{
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"structure_string": "Li1 Mg6 Ga1\n1.0\n6.256828 0.000131 0.000000\n-3.128300 5.418375 0.000000\n0.000000 0.000000 4.996591\nLi Mg Ga\n1 6 1\ndirect\n0.166120 0.333059 0.250000 Li\n0.668869 0.332871 0.250000 Mg\n0.668869 0.835997 0.250000 Mg\n0.327156 0.163860 0.750000 Mg\n0.327156 0.663296 0.750000 Mg\n0.836197 0.168098 0.750000 Mg\n0.835704 0.667852 0.750000 Mg\n0.169928 0.834963 0.250000 Ga\n",
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{
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{
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"structure_string": "Mn3 Ni1 O4\n1.0\n-0.000000 2.172407 2.172407\n-4.440082 2.140942 -2.140942\n-4.440082 -2.140942 2.140942\nMn Ni O\n3 1 4\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500001 0.000000 0.500000 Mn\n0.500001 0.500000 0.000000 Mn\n0.000000 0.000000 0.000000 Ni\n0.000000 0.736823 0.736823 O\n0.500001 0.245540 0.754460 O\n0.500001 0.754460 0.245540 O\n0.000000 0.263176 0.263176 O\n",
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}