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{
"id": "jvasp-57360",
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"structure_string": "Tl1 Cr3 O8\n1.0\n5.079313 -0.103468 -0.122642\n2.197220 4.580648 -0.122642\n-0.499331 -0.307233 7.766874\nTl Cr O\n1 3 8\ndirect\n0.000000 0.000000 0.000000 Tl\n0.377708 0.377709 0.700189 Cr\n0.622291 0.622292 0.299811 Cr\n-0.000000 0.000000 0.500000 Cr\n0.740047 0.233701 0.676740 O\n0.766299 0.259952 0.323260 O\n0.223541 0.223542 0.550940 O\n0.776458 0.776459 0.449060 O\n0.324735 0.324736 0.894607 O\n0.675264 0.675264 0.105393 O\n0.259952 0.766300 0.323260 O\n0.233700 0.740048 0.676740 O\n",
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{
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"structure_string": "B2 H6 O2 F8\n1.0\n4.448566 0.098045 0.806299\n0.103369 5.855496 1.069299\n-0.069071 0.075274 6.275668\nB H O F\n2 6 2 8\ndirect\n0.568237 0.792662 0.797085 B\n0.431764 0.207338 0.202916 B\n0.861349 0.689592 0.158907 H\n0.138653 0.310407 0.841094 H\n0.757650 0.677774 0.430178 H\n0.242352 0.322225 0.569823 H\n0.049223 0.831941 0.295084 H\n0.950778 0.168058 0.704916 H\n0.069738 0.307375 0.696434 O\n0.930264 0.692624 0.303566 O\n0.740754 0.659225 0.948041 F\n0.259247 0.340774 0.051959 F\n0.739547 0.979137 0.669623 F\n0.260455 0.020863 0.330377 F\n0.515750 0.653189 0.645261 F\n0.484251 0.346810 0.354740 F\n0.299475 0.872502 0.903666 F\n0.700527 0.127497 0.096335 F\n",
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{
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"created_at": "2022-09-04T14:38:17.223066Z",
"updated_at": "2022-09-04T14:38:17.223092Z",
"structure_string": "Fe1 P2 O7\n1.0\n5.021975 -0.015420 -0.726031\n1.029412 4.915361 0.726031\n0.007619 -0.009410 4.487898\nFe P O\n1 2 7\ndirect\n0.112243 0.112243 -0.000000 Fe\n0.263469 0.667525 0.592671 P\n0.667524 0.263469 0.407330 P\n0.550367 0.550369 0.500001 O\n0.145356 0.431351 0.728229 O\n0.073023 0.811467 0.294273 O\n0.337690 0.854245 0.818831 O\n0.811466 0.073021 0.705728 O\n0.854244 0.337690 0.181169 O\n0.431349 0.145356 0.271771 O\n",
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{
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"structure_string": "Ca2 Zn1 Ga1\n1.0\n4.463859 -0.000000 2.577210\n1.487953 4.208566 2.577210\n-0.000000 -0.000000 5.154420\nCa Zn Ga\n2 1 1\ndirect\n0.750000 0.750001 0.750000 Ca\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Ga\n",
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{
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"structure_string": "Ti2 Zn2 F8\n1.0\n-5.146193 -0.000058 -0.000790\n-0.000117 -5.146594 -0.014789\n2.569037 2.554125 5.158957\nTi Zn F\n2 2 8\ndirect\n0.002041 0.499647 -0.001730 Ti\n0.502033 -0.000347 -0.001728 Ti\n0.752303 0.749808 0.498243 Zn\n0.251749 0.249410 0.498238 Zn\n0.665526 0.663208 0.753582 F\n0.909831 0.907376 0.243168 F\n0.338659 0.336200 0.243002 F\n0.409832 0.836277 0.243106 F\n0.094195 0.091846 0.753398 F\n0.165450 0.591879 0.753500 F\n0.594216 0.163170 0.753533 F\n0.838742 0.407348 0.243101 F\n",
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{
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"created_at": "2022-09-04T14:38:17.215471Z",
"updated_at": "2022-09-04T14:38:17.215497Z",
"structure_string": "Ba2 Ta1 Bi1 O6\n1.0\n5.279126 -0.000057 3.024489\n1.785920 4.980797 3.002081\n-0.000370 -0.022784 6.119929\nBa Ta Bi O\n2 1 1 6\ndirect\n0.751172 0.753561 0.744092 Ba\n0.248829 0.246440 0.255908 Ba\n0.500000 0.500000 0.500000 Ta\n0.000000 -0.000000 -0.000000 Bi\n0.302907 0.237328 0.692012 O\n0.697094 0.762672 0.307987 O\n0.767752 0.237334 0.692023 O\n0.728779 0.336152 0.206296 O\n0.232248 0.762666 0.307977 O\n0.271221 0.663849 0.793703 O\n",
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{
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"created_at": "2022-09-04T14:38:17.207677Z",
"updated_at": "2022-09-04T14:38:17.207711Z",
"structure_string": "K2 Tl1 Bi1 F6\n1.0\n5.935221 -0.000000 3.426702\n1.978407 5.595780 3.426702\n-0.000000 -0.000000 6.853403\nK Tl Bi F\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.499999 Tl\n0.000000 0.000000 0.000000 Bi\n0.766961 0.233038 0.233038 F\n0.233039 0.233038 0.766961 F\n0.233039 0.766962 0.766961 F\n0.233039 0.766962 0.233038 F\n0.766961 0.233038 0.766961 F\n0.766962 0.766962 0.233038 F\n",
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"structure_string": "Ba2 Bi1 Sb1 O6\n1.0\n5.276925 0.000000 3.032889\n1.784846 4.989484 3.001651\n-0.005776 -0.007115 6.117155\nBa Bi Sb O\n2 1 1 6\ndirect\n0.248817 0.247744 0.254621 Ba\n0.751182 0.752255 0.745379 Ba\n0.000000 0.000000 0.000000 Bi\n0.500000 0.499999 0.500000 Sb\n0.297304 0.238423 0.698383 O\n0.234110 0.761575 0.301617 O\n0.702696 0.761575 0.301617 O\n0.765889 0.238423 0.698383 O\n0.731352 0.327315 0.209979 O\n0.268647 0.672683 0.790021 O\n",
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"updated_at": "2022-09-04T14:38:17.197742Z",
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{
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"structure_string": "Rb12 Bi4 Se12\n1.0\n10.121481 0.000000 -0.000000\n-0.000000 10.121481 0.000000\n-0.000000 -0.000000 10.121481\nRb Bi Se\n12 4 12\ndirect\n0.324028 0.324028 0.324028 Rb\n0.175972 0.675972 0.824028 Rb\n0.824028 0.175972 0.675972 Rb\n0.675972 0.824028 0.175972 Rb\n0.569787 0.569787 0.569787 Rb\n0.930213 0.430213 0.069787 Rb\n0.069787 0.930213 0.430213 Rb\n0.430213 0.069787 0.930213 Rb\n0.813842 0.813842 0.813842 Rb\n0.686158 0.186158 0.313842 Rb\n0.313842 0.686158 0.186158 Rb\n0.186158 0.313842 0.686158 Rb\n0.965128 0.534872 0.465128 Bi\n0.534872 0.465128 0.965128 Bi\n0.465128 0.965128 0.534872 Bi\n0.034872 0.034872 0.034872 Bi\n0.219696 0.612012 0.499019 Se\n0.499019 0.219696 0.612012 Se\n0.612012 0.499019 0.219696 Se\n0.887988 0.500981 0.719696 Se\n0.999019 0.280304 0.387988 Se\n0.387988 0.999019 0.280304 Se\n0.000981 0.780304 0.112012 Se\n0.500981 0.719696 0.887988 Se\n0.112012 0.000981 0.780304 Se\n0.719696 0.887988 0.500981 Se\n0.780304 0.112012 0.000981 Se\n0.280304 0.387988 0.999019 Se\n",
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}