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{
"id": "jvasp-91907",
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{
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{
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"structure_string": "Na4 Zr2 Si8 O22\n1.0\n7.487252 -0.021516 1.008284\n0.553374 7.466805 1.008284\n0.005744 0.005319 8.624547\nNa Zr Si O\n4 2 8 22\ndirect\n0.073526 0.926474 0.250000 Na\n0.926472 0.073527 0.750000 Na\n0.391318 0.608682 0.250000 Na\n0.608681 0.391318 0.750000 Na\n0.500000 -0.000000 -0.000000 Zr\n-0.000001 0.500000 0.500000 Zr\n0.804122 0.663526 0.139472 Si\n0.336473 0.195878 0.360527 Si\n0.733598 0.166400 0.429087 Si\n0.166400 0.733599 0.929087 Si\n0.266401 0.833600 0.570913 Si\n0.195877 0.336474 0.860527 Si\n0.833599 0.266401 0.070913 Si\n0.663525 0.804123 0.639473 Si\n0.755696 0.956361 0.504521 O\n0.245713 0.526090 0.917934 O\n0.473910 0.754286 0.582066 O\n0.043639 0.244303 0.995479 O\n0.204728 0.376194 0.351666 O\n0.840049 0.159951 0.250000 O\n0.623805 0.795272 0.148334 O\n0.795271 0.623806 0.648334 O\n0.376194 0.204728 0.851666 O\n0.108830 0.376343 0.697003 O\n0.623656 0.891170 0.802996 O\n0.891169 0.623657 0.302996 O\n0.244303 0.043639 0.495479 O\n0.376343 0.108830 0.197003 O\n0.715901 0.172887 0.965508 O\n0.172887 0.715903 0.465507 O\n0.284097 0.827113 0.034492 O\n0.754286 0.473910 0.082066 O\n0.526089 0.245714 0.417934 O\n0.159950 0.840050 0.750000 O\n0.827112 0.284098 0.534492 O\n0.956360 0.755697 0.004520 O\n",
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{
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{
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"structure_string": "Na4 V4 O12\n1.0\n3.620899 -0.000000 0.000000\n-0.000000 5.304681 0.000000\n0.000000 0.000000 14.387319\nNa V O\n4 4 12\ndirect\n0.250000 0.869048 0.330102 Na\n0.750000 0.130952 0.669898 Na\n0.750000 0.369048 0.169898 Na\n0.250000 0.630952 0.830102 Na\n0.750000 0.087002 0.915427 V\n0.250000 0.912997 0.084573 V\n0.250000 0.587002 0.584573 V\n0.750000 0.412997 0.415427 V\n0.250000 0.605447 0.104898 O\n0.250000 0.894552 0.604898 O\n0.750000 0.932207 0.813113 O\n0.750000 0.567793 0.313113 O\n0.750000 -0.005936 0.052416 O\n0.750000 0.105448 0.395102 O\n0.750000 0.505936 0.552416 O\n0.250000 0.494064 0.447584 O\n0.250000 0.067793 0.186887 O\n0.250000 0.432207 0.686887 O\n0.750000 0.394552 0.895102 O\n0.250000 0.005936 0.947584 O\n",
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{
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"created_at": "2022-09-04T14:38:37.643759Z",
"updated_at": "2022-09-04T14:38:37.643779Z",
"structure_string": "Rb2 Li1 Y1 Cl6\n1.0\n6.295958 -0.000000 3.634973\n2.098653 5.935886 3.634973\n-0.000000 -0.000000 7.269946\nRb Li Y Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Y\n0.745676 0.254325 0.254324 Cl\n0.254324 0.254325 0.745676 Cl\n0.254324 0.745676 0.745675 Cl\n0.254324 0.745676 0.254324 Cl\n0.745676 0.254325 0.745675 Cl\n0.745675 0.745676 0.254324 Cl\n",
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{
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"created_at": "2022-09-04T14:38:06.587436Z",
"updated_at": "2022-09-04T14:38:06.587464Z",
"structure_string": "As4 Cl8 F12\n1.0\n8.584784 -0.000000 0.000000\n0.000000 8.584784 -0.000000\n-0.000000 -0.000000 6.238052\nAs Cl F\n4 8 12\ndirect\n-0.000000 0.500000 0.678456 As\n0.500000 0.000000 0.321544 As\n0.000000 0.000000 0.000000 As\n0.500000 0.500000 0.000000 As\n0.046434 0.808212 0.199114 Cl\n0.808212 0.953566 0.800885 Cl\n0.453566 0.691788 0.800885 Cl\n0.308212 0.453566 0.199114 Cl\n0.191788 0.046434 0.800885 Cl\n0.691788 0.546433 0.199114 Cl\n0.953566 0.191788 0.199114 Cl\n0.546433 0.308212 0.800885 Cl\n-0.000000 0.500000 0.959956 F\n-0.000000 0.500000 0.392628 F\n0.500000 0.000000 0.607371 F\n0.923719 0.307280 0.675780 F\n0.807280 0.576280 0.675780 F\n0.192719 0.423719 0.675780 F\n0.076280 0.692719 0.675780 F\n0.576280 0.192719 0.324219 F\n0.692719 0.923719 0.324219 F\n0.307280 0.076280 0.324219 F\n0.500000 0.000000 0.040043 F\n0.423719 0.807280 0.324219 F\n",
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{
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"structure_string": "Mg1 Ti1 Be1\n1.0\n-1.429304 1.429304 5.630224\n1.429304 -1.429304 5.630224\n1.429304 1.429304 -5.630224\nMg Ti Be\n1 1 1\ndirect\n0.351364 0.351364 0.000000 Mg\n0.640656 0.640656 0.000000 Ti\n0.007979 0.007979 0.000000 Be\n",
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{
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"structure_string": "Rb1 Mg6 Mo1\n1.0\n6.460775 0.002567 0.000000\n-3.228165 5.596478 0.000000\n0.000000 0.000000 5.127797\nRb Mg Mo\n1 6 1\ndirect\n0.083330 0.416671 0.250000 Rb\n0.117806 0.933871 0.250000 Mg\n0.566129 0.382195 0.250000 Mg\n0.566325 0.933676 0.250000 Mg\n0.435440 0.592926 0.750000 Mg\n0.907074 0.064561 0.750000 Mg\n0.907157 0.592844 0.750000 Mg\n0.416740 0.083260 0.750000 Mo\n",
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]
}