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{
"id": "jvasp-46244",
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{
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"structure_string": "Na2 Lu1 Cu1 Cl6\n1.0\n6.165807 0.000000 3.559830\n2.055269 5.813178 3.559830\n0.000000 0.000000 7.119661\nNa Lu Cu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Lu\n0.500000 0.500000 0.500000 Cu\n0.747073 0.252928 0.252927 Cl\n0.252928 0.252928 0.747072 Cl\n0.252928 0.747073 0.747072 Cl\n0.252928 0.747073 0.252927 Cl\n0.747073 0.252928 0.747072 Cl\n0.747073 0.747073 0.252927 Cl\n",
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{
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"structure_string": "V4 O4 F12\n1.0\n5.625160 0.000000 0.000000\n0.000000 5.622195 0.000000\n0.000000 0.000000 8.045094\nV O F\n4 4 12\ndirect\n0.483553 0.330404 0.250017 V\n0.483553 0.669597 0.750017 V\n0.983553 0.830405 0.249982 V\n0.983553 0.169596 0.749982 V\n0.270020 0.480571 0.750025 O\n0.270020 0.519430 0.250025 O\n0.770020 0.019429 0.249975 O\n0.770020 0.980571 0.749974 O\n0.743475 0.475742 0.750117 F\n0.743475 0.524259 0.250117 F\n0.499869 0.756132 0.960478 F\n0.499869 0.243869 0.460478 F\n0.500045 0.755868 0.539511 F\n0.999869 0.256132 0.539521 F\n0.243475 0.975742 0.749882 F\n0.243475 0.024259 0.249882 F\n0.000045 0.255867 0.960488 F\n0.999869 0.743869 0.039521 F\n0.500045 0.244133 0.039511 F\n0.000045 0.744134 0.460488 F\n",
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{
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"structure_string": "K4 Na2 Ga2 As4\n1.0\n-6.604993 0.000582 -0.001334\n-0.000858 -6.696232 -0.002794\n3.301398 3.344788 7.445909\nK Na Ga As\n4 2 2 4\ndirect\n0.326865 0.586386 0.653724 K\n0.826878 0.067349 0.653736 K\n0.173122 0.932651 0.346265 K\n0.673135 0.413614 0.346277 K\n0.749994 0.000002 -0.000004 Na\n0.250006 -0.000001 0.000005 Na\n0.250000 0.500001 -0.000002 Ga\n0.750000 0.500000 0.000003 Ga\n0.596959 0.802048 0.193906 As\n0.403041 0.197953 0.806095 As\n0.903053 0.608158 0.806098 As\n0.096947 0.391842 0.193903 As\n",
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{
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"updated_at": "2022-09-04T14:36:03.126141Z",
"structure_string": "Li2 Mn4 F10\n1.0\n4.061337 0.000000 0.000000\n-2.030669 5.194415 0.000000\n-0.000000 0.000000 10.304999\nLi Mn F\n2 4 10\ndirect\n0.177709 0.355421 0.250000 Li\n0.822292 0.644580 0.750000 Li\n0.138784 0.277570 0.571072 Mn\n0.138784 0.277570 0.928928 Mn\n0.861217 0.722431 0.071072 Mn\n0.861217 0.722431 0.428928 Mn\n0.309673 0.619346 0.429876 F\n0.053647 0.107293 0.116638 F\n0.053647 0.107293 0.383362 F\n0.309673 0.619346 0.070124 F\n0.241268 0.482534 0.750000 F\n0.758733 0.517467 0.250000 F\n0.946354 0.892707 0.616638 F\n0.690328 0.380655 0.570124 F\n0.690328 0.380655 0.929876 F\n0.946354 0.892707 0.883362 F\n",
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{
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"created_at": "2022-09-04T14:35:47.715138Z",
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"structure_string": "Nb4 Se8 S4 N8 Cl4 F24\n1.0\n7.907840 0.000000 0.000000\n0.000000 9.899342 -3.393660\n0.000000 -0.130489 12.115938\nNb Se S N Cl F\n4 8 4 8 4 24\ndirect\n0.821350 0.911591 0.683438 Nb\n0.178650 0.088409 0.316562 Nb\n0.321350 0.588409 0.816562 Nb\n0.678650 0.411591 0.183438 Nb\n0.821617 0.719531 0.023350 Se\n0.917057 0.323594 0.650103 Se\n0.417057 0.176406 0.849898 Se\n0.321617 0.780469 0.476650 Se\n0.678383 0.219531 0.523350 Se\n0.082943 0.676406 0.349898 Se\n0.582943 0.823594 0.150102 Se\n0.178383 0.280469 0.976650 Se\n0.231804 -0.006845 0.943306 S\n0.731804 0.506845 0.556694 S\n0.768196 0.006845 0.056694 S\n0.268196 0.493155 0.443306 S\n0.893408 0.480641 0.624751 N\n0.377757 0.623120 0.495233 N\n0.106592 0.519359 0.375249 N\n0.606592 0.980641 0.124751 N\n0.122243 0.123120 -0.004767 N\n0.393408 0.019359 0.875249 N\n0.622243 0.376880 0.504767 N\n0.877757 0.876879 0.004767 N\n0.801575 0.361901 0.834231 Cl\n0.698425 0.861901 0.334230 Cl\n0.301575 0.138099 0.665770 Cl\n0.198425 0.638099 0.165770 Cl\n0.723541 0.279943 0.257665 F\n0.090467 0.601716 0.874397 F\n0.110898 0.234060 0.458563 F\n0.445322 0.434493 0.230994 F\n0.143407 0.952691 0.395689 F\n0.776459 0.779942 0.757665 F\n0.259431 0.444009 0.674869 F\n0.909533 0.398284 0.125603 F\n0.054678 0.934493 0.730994 F\n0.643407 0.547308 0.104311 F\n0.610898 0.265940 0.041437 F\n0.276459 0.720057 0.742335 F\n0.856593 0.047308 0.604311 F\n0.590467 0.898284 0.625603 F\n0.889102 0.765940 0.541437 F\n0.240569 0.944009 0.174869 F\n0.389102 0.734060 0.958563 F\n0.759431 0.055991 0.825131 F\n0.945322 0.065507 0.269006 F\n0.554678 0.565507 0.769006 F\n0.223541 0.220057 0.242335 F\n0.356593 0.452691 0.895689 F\n0.409533 0.101716 0.374397 F\n0.740569 0.555991 0.325131 F\n",
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"structure_string": "Li2 Cr4 S8\n1.0\n6.222700 -0.000000 -3.266997\n-1.715214 5.981642 -3.266997\n-0.287595 -0.381654 7.011948\nLi Cr S\n2 4 8\ndirect\n0.375001 0.625001 0.750000 Li\n0.624999 0.375000 0.250000 Li\n0.000000 0.500001 0.000001 Cr\n0.000001 0.000000 0.500000 Cr\n0.500001 0.000000 0.500000 Cr\n0.000000 0.000000 0.000000 Cr\n0.760022 0.780071 0.520045 S\n0.760026 0.239980 0.979957 S\n0.219930 0.239980 0.979956 S\n0.239978 0.219930 0.479956 S\n0.239978 0.760025 0.479955 S\n0.239974 0.760021 0.020045 S\n0.760021 0.239974 0.520044 S\n0.780070 0.760021 0.020044 S\n",
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}
]
}