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"structure_string": "Ba2 B4 Se12\n1.0\n6.881898 0.020106 -0.000000\n-2.544468 6.394264 -0.000000\n0.000000 0.000000 10.297987\nBa B Se\n2 4 12\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.613824 0.386176 0.000000 B\n0.386176 0.613824 0.000000 B\n0.886176 0.113825 0.500000 B\n0.113824 0.886175 0.500000 B\n0.600905 0.600905 0.859808 Se\n0.100905 0.100905 0.640193 Se\n0.107375 0.524109 0.904255 Se\n0.607375 0.024109 0.595746 Se\n0.475891 0.892625 0.095745 Se\n0.524109 0.107375 0.904255 Se\n0.975891 0.392625 0.404255 Se\n0.899095 0.899095 0.359807 Se\n0.399095 0.399095 0.140193 Se\n0.892625 0.475891 0.095745 Se\n0.024109 0.607375 0.595746 Se\n0.392625 0.975891 0.404255 Se\n",
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{
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"structure_string": "Ca2 V4 O8\n1.0\n3.090623 -0.000449 -0.002081\n-1.544426 6.686230 -0.006254\n-1.540228 -1.382465 7.664324\nCa V O\n2 4 8\ndirect\n0.517074 0.863756 0.162407 Ca\n0.463390 0.103182 0.815707 Ca\n0.801697 0.434542 0.160917 V\n0.649495 0.777924 0.513226 V\n0.330911 0.189018 0.464889 V\n0.178774 0.532391 0.817200 V\n0.542198 0.400968 0.675459 O\n0.763118 0.216742 0.301641 O\n0.217273 0.750194 0.676472 O\n0.438307 0.565970 0.302656 O\n0.149541 0.301372 0.989851 O\n0.137208 0.891576 0.374920 O\n0.830884 0.665560 0.988264 O\n0.843226 0.075367 0.603195 O\n",
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{
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"updated_at": "2022-09-04T14:37:08.851811Z",
"structure_string": "Tl4 Sb4 Se8\n1.0\n0.000000 9.241932 -0.000320\n4.146437 0.000000 0.000000\n0.000000 -4.312454 -12.090889\nTl Sb Se\n4 4 8\ndirect\n0.682783 0.246627 0.138784 Tl\n0.055335 0.241412 0.359360 Tl\n0.317218 0.746627 0.861216 Tl\n0.944665 0.741412 0.640640 Tl\n0.184854 0.246990 0.110255 Sb\n0.815146 0.746991 0.889745 Sb\n0.580272 0.240004 0.388891 Sb\n0.419728 0.740005 0.611109 Sb\n0.061025 0.245971 0.893471 Se\n0.345384 0.742199 0.393826 Se\n0.654616 0.242199 0.606174 Se\n0.790368 0.742180 0.388804 Se\n0.392857 0.746318 0.118559 Se\n0.209632 0.242179 0.611196 Se\n0.938975 0.745972 0.106529 Se\n0.607143 0.246318 0.881441 Se\n",
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{
"id": "jvasp-42396",
"created_at": "2022-09-04T14:37:08.854381Z",
"updated_at": "2022-09-04T14:37:08.854392Z",
"structure_string": "V4 O3 F5\n1.0\n-0.139596 4.721811 3.064134\n-0.139596 4.721811 -3.064134\n-4.721811 0.139596 -3.064134\nV O F\n4 3 5\ndirect\n0.232481 0.254705 0.512815 V\n0.767521 0.719665 0.512815 V\n0.500001 0.526993 0.973007 V\n0.000001 0.990337 0.009663 V\n0.500001 0.819667 0.680333 O\n0.000001 0.286703 0.713296 O\n0.000001 0.697040 0.302959 O\n0.054532 0.746157 0.801601 F\n0.547762 0.252930 0.801601 F\n0.500000 0.206708 0.293292 F\n0.452240 0.746157 0.199311 F\n0.945469 0.252930 0.199311 F\n",
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"structure_string": "Li5 Cu1 F8\n1.0\n4.998074 -0.018684 0.000000\n-1.716492 4.694118 0.000000\n0.000000 0.000000 5.851415\nLi Cu F\n5 1 8\ndirect\n0.000000 0.500000 0.227969 Li\n0.000000 0.500000 0.772032 Li\n0.500000 0.500001 0.000000 Li\n0.500000 0.000000 0.227969 Li\n0.500000 0.000000 0.772032 Li\n0.500000 0.500001 0.500000 Cu\n0.264232 0.735769 0.000000 F\n0.265971 0.734030 0.500000 F\n0.271179 0.271179 0.260263 F\n0.271179 0.271179 0.739738 F\n0.728821 0.728822 0.260263 F\n0.728821 0.728822 0.739738 F\n0.734029 0.265972 0.500000 F\n0.735768 0.264233 0.000000 F\n",
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"structure_string": "Cu1 Sb1 Pd2\n1.0\n-8.335426 -0.000000 -4.812460\n-8.658391 -0.005983 5.371853\n-5.661785 8.469699 0.181579\nCu Sb Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500000 0.000000 0.000000 Sb\n0.747832 0.000000 0.000000 Pd\n0.252168 0.000000 0.000000 Pd\n",
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"created_at": "2022-09-04T14:37:28.956137Z",
"updated_at": "2022-09-04T14:37:28.956170Z",
"structure_string": "Ca3 Bi1 As1\n1.0\n5.491650 -0.000000 0.000000\n-0.000000 5.491650 -0.000000\n0.000000 0.000000 5.491650\nCa Bi As\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Ca\n0.500000 0.000000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n0.000000 0.000000 0.000000 Bi\n0.500000 0.500000 0.500000 As\n",
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{
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"structure_string": "Li2 V4 O10\n1.0\n3.616909 0.000000 0.000000\n-1.808454 4.939126 0.000000\n0.000000 -0.000000 11.321937\nLi V O\n2 4 10\ndirect\n0.899126 0.798247 0.750000 Li\n0.100876 0.201752 0.250000 Li\n0.204160 0.408319 0.601581 V\n0.204160 0.408319 0.898419 V\n0.795843 0.591683 0.101581 V\n0.795843 0.591683 0.398419 V\n0.958138 0.916271 0.126218 O\n0.715201 0.430399 0.250000 O\n0.284801 0.569600 0.750000 O\n0.241691 0.483380 0.071284 O\n0.041865 0.083730 0.626218 O\n0.958138 0.916271 0.373783 O\n0.758312 0.516621 0.928717 O\n0.758312 0.516621 0.571284 O\n0.241691 0.483380 0.428716 O\n0.041865 0.083730 0.873782 O\n",
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}