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{
"id": "jvasp-99694",
"created_at": "2022-09-04T14:36:39.621208Z",
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"structure_string": "K2 Na1 Ir1 F6\n1.0\n5.165006 0.000000 2.982018\n1.721669 4.869614 2.982018\n0.000000 -0.000000 5.964036\nK Na Ir F\n2 1 1 6\ndirect\n0.750001 0.749999 0.750001 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.500001 Na\n0.000000 0.000000 0.000000 Ir\n0.759546 0.240455 0.240455 F\n0.240455 0.240455 0.759546 F\n0.240456 0.759544 0.759546 F\n0.240456 0.759544 0.240456 F\n0.759546 0.240455 0.759546 F\n0.759546 0.759544 0.240456 F\n",
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{
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"updated_at": "2022-09-04T14:36:19.737188Z",
"structure_string": "K2 La2 Ti3 O10\n1.0\n3.867973 -0.000000 -0.498613\n-0.064275 3.867439 -0.498613\n-0.013555 -0.013782 15.147000\nK La Ti O\n2 2 3 10\ndirect\n0.707970 0.707972 0.415942 K\n0.292029 0.292029 0.584059 K\n0.571784 0.571785 0.143570 La\n0.428215 0.428215 0.856430 La\n0.000000 0.000000 0.000000 Ti\n0.859048 0.859050 0.718099 Ti\n0.140951 0.140951 0.281901 Ti\n0.064704 0.064704 0.129408 O\n0.799840 0.799842 0.599683 O\n0.935295 0.935297 0.870593 O\n0.627390 0.127390 0.254780 O\n0.127389 0.627390 0.254780 O\n0.372610 0.872611 0.745220 O\n0.872610 0.372610 0.745220 O\n0.200159 0.200159 0.400318 O\n0.500000 0.000000 0.000000 O\n-0.000001 0.500000 0.000000 O\n",
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"formula_full": "K2 La2 Ti3 O10",
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{
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"created_at": "2022-09-04T14:36:09.566733Z",
"updated_at": "2022-09-04T14:36:09.566759Z",
"structure_string": "Ba1 Bi4 Cl2 O6\n1.0\n3.966950 0.000000 -0.501518\n-0.063405 3.966443 -0.501518\n0.018454 0.018752 16.085806\nBa Bi Cl O\n1 4 2 6\ndirect\n0.500001 0.500000 -0.000000 Ba\n0.211043 0.211043 0.422086 Bi\n0.788957 0.788955 0.577914 Bi\n0.910734 0.910733 0.821468 Bi\n0.089266 0.089266 0.178532 Bi\n0.332859 0.332858 0.665719 Cl\n0.667141 0.667140 0.334281 Cl\n0.441316 0.941315 0.882632 O\n0.058684 0.558683 0.117368 O\n0.558684 0.058684 0.117368 O\n0.941316 0.441315 0.882632 O\n0.250000 0.749999 0.500000 O\n0.750000 0.250000 0.500000 O\n",
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{
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"updated_at": "2022-09-04T14:36:37.296658Z",
"structure_string": "K2 Li1 As1 F6\n1.0\n5.028486 -0.000000 2.903198\n1.676162 4.740902 2.903198\n-0.000000 -0.000000 5.806396\nK Li As F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500001 Li\n0.000000 0.000000 0.000000 As\n0.748300 0.251700 0.251701 F\n0.251701 0.251700 0.748300 F\n0.251700 0.748299 0.748301 F\n0.251700 0.748299 0.251701 F\n0.748300 0.251700 0.748300 F\n0.748300 0.748299 0.251701 F\n",
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{
"id": "jvasp-99630",
"created_at": "2022-09-04T14:36:39.654055Z",
"updated_at": "2022-09-04T14:36:39.654075Z",
"structure_string": "K2 Y1 Hg1 Br6\n1.0\n7.029040 -0.000000 4.058218\n2.343013 6.627043 4.058218\n-0.000000 -0.000000 8.116436\nK Y Hg Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500001 Hg\n0.759163 0.240837 0.240837 Br\n0.240837 0.240837 0.759164 Br\n0.240836 0.759163 0.759164 Br\n0.240836 0.759163 0.240837 Br\n0.759163 0.240837 0.759164 Br\n0.759163 0.759163 0.240837 Br\n",
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{
"id": "jvasp-95288",
"created_at": "2022-09-04T14:36:09.874438Z",
"updated_at": "2022-09-04T14:36:09.874456Z",
"structure_string": "Sr2 C4 S4 N4\n1.0\n5.960303 0.032115 0.123000\n2.275318 5.509007 0.123000\n0.016821 0.011317 8.040539\nSr C S N\n2 4 4 4\ndirect\n0.907904 0.092096 0.750000 Sr\n0.092096 0.907904 0.250000 Sr\n0.753255 0.486482 0.101618 C\n0.486482 0.753255 0.601618 C\n0.246745 0.513519 0.898382 C\n0.513518 0.246745 0.398382 C\n0.353645 0.237677 0.829604 S\n0.762323 0.646354 0.670396 S\n0.646354 0.762323 0.170396 S\n0.237677 0.353646 0.329604 S\n0.835356 0.283765 0.052642 N\n0.283765 0.835357 0.552642 N\n0.716235 0.164643 0.447358 N\n0.164643 0.716236 0.947358 N\n",
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{
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"created_at": "2022-09-04T14:36:33.396730Z",
"updated_at": "2022-09-04T14:36:33.396749Z",
"structure_string": "Yb1 Nb1 Pb2 O6\n1.0\n5.156651 -0.000000 2.977194\n1.718884 4.861737 2.977194\n-0.000000 -0.000000 5.954388\nYb Nb Pb O\n1 1 2 6\ndirect\n0.499999 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 Nb\n0.250000 0.250000 0.250000 Pb\n0.749999 0.750000 0.749999 Pb\n0.762618 0.237382 0.237381 O\n0.237381 0.762619 0.762618 O\n0.237381 0.237382 0.762618 O\n0.762617 0.762619 0.237381 O\n0.237381 0.762619 0.237381 O\n0.762618 0.237382 0.762618 O\n",
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"formula_full": "Yb1 Nb1 Pb2 O6",
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{
"id": "jvasp-99660",
"created_at": "2022-09-04T14:36:20.473013Z",
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"structure_string": "Ce1 Y2 Al3 Pd3\n1.0\n7.243536 -0.023517 0.000000\n-3.544254 6.317249 0.000000\n0.000000 0.000000 3.991471\nCe Y Al Pd\n1 2 3 3\ndirect\n0.580193 0.580193 0.500000 Ce\n0.415819 0.001149 0.500000 Y\n0.001150 0.415819 0.500000 Y\n0.234370 0.234369 -0.000000 Al\n0.760098 0.004037 -0.000000 Al\n0.004038 0.760098 -0.000000 Al\n0.338561 0.667212 -0.000000 Pd\n0.667212 0.338560 -0.000000 Pd\n-0.001538 -0.001538 0.500000 Pd\n",
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{
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"created_at": "2022-09-04T14:36:37.290802Z",
"updated_at": "2022-09-04T14:36:37.290821Z",
"structure_string": "Y1 Mn1 W2 O8\n1.0\n5.095700 -0.006275 -0.073786\n-0.014134 5.903192 -0.005459\n-2.172107 -2.042804 5.165404\nY Mn W O\n1 1 2 8\ndirect\n0.525629 0.276493 0.901773 Y\n0.032314 0.749534 0.883861 Mn\n0.279267 0.602670 0.413200 W\n0.771931 0.955538 0.387848 W\n0.297023 0.325972 0.168115 O\n0.259483 0.508970 0.674264 O\n0.373291 0.805144 0.205374 O\n0.173338 0.950154 0.610716 O\n0.787565 0.057764 0.136099 O\n0.746006 0.231480 0.631681 O\n0.677705 0.749091 0.601005 O\n0.876349 0.608700 0.189955 O\n",
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{
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"created_at": "2022-09-04T14:36:20.428768Z",
"updated_at": "2022-09-04T14:36:20.428791Z",
"structure_string": "Li3 Ti2 Cu1 O6\n1.0\n15.499600 -0.004014 -0.002455\n9.487969 2.856676 0.019960\n9.487969 1.318946 2.534043\nLi Ti Cu O\n3 2 1 6\ndirect\n0.166666 0.500002 0.500000 Li\n0.515632 0.489561 0.489559 Li\n0.817698 0.510443 0.510442 Li\n0.033900 0.976607 0.976603 Ti\n0.299431 0.023396 0.023397 Ti\n0.666666 0.000000 0.000001 Cu\n0.192713 0.295057 0.295056 O\n0.566810 0.270761 0.270760 O\n0.140618 0.704947 0.704943 O\n0.954994 0.222020 0.222020 O\n0.378336 0.777984 0.777981 O\n0.766521 0.729243 0.729241 O\n",
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{
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"created_at": "2022-09-04T14:36:08.689423Z",
"updated_at": "2022-09-04T14:36:08.689445Z",
"structure_string": "Sr4 Zr4 Si8 O28\n1.0\n7.253854 0.000000 -2.918414\n0.000000 8.115250 0.000000\n0.011966 0.000000 10.167016\nSr Zr Si O\n4 4 8 28\ndirect\n0.283417 0.482158 0.294687 Sr\n0.716583 0.982158 0.205313 Sr\n0.283417 0.017842 0.794687 Sr\n0.716583 0.517842 0.705314 Sr\n0.256709 0.489202 0.744792 Zr\n0.743292 0.989202 0.755209 Zr\n0.743291 0.510798 0.255209 Zr\n0.256708 0.010798 0.244792 Zr\n0.066212 0.246929 0.458529 Si\n0.933788 0.746929 0.041471 Si\n0.933788 0.753071 0.541472 Si\n0.675196 0.213394 0.461201 Si\n0.324804 0.713394 0.038800 Si\n0.324804 0.786606 0.538800 Si\n0.675196 0.286606 0.961201 Si\n0.066212 0.253071 0.958529 Si\n0.807886 0.731281 0.374172 O\n0.012241 0.078520 0.870797 O\n0.987759 0.578520 0.629204 O\n0.987759 0.921480 0.129204 O\n0.012241 0.421480 0.370797 O\n0.192113 0.231281 0.125828 O\n0.631121 0.093739 0.906589 O\n0.868370 0.345907 0.939342 O\n0.368879 0.593739 0.593412 O\n0.368879 0.906261 0.093412 O\n0.631121 0.406261 0.406589 O\n0.695847 0.293487 0.126816 O\n0.304152 0.793487 0.373185 O\n0.304152 0.706513 0.873185 O\n0.695848 0.206513 0.626816 O\n0.525164 0.409521 0.850463 O\n0.192113 0.268719 0.625829 O\n0.474836 0.909521 0.649538 O\n0.525164 0.090479 0.350463 O\n0.172831 0.366613 0.882129 O\n0.827169 0.866613 0.617872 O\n0.827169 0.633387 0.117872 O\n0.172831 0.133387 0.382128 O\n0.868370 0.154093 0.439342 O\n0.131630 0.654093 0.060658 O\n0.131630 0.845907 0.560658 O\n0.474836 0.590479 0.149538 O\n0.807887 0.768719 0.874172 O\n",
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"formula_full": "Sr4 Zr4 Si8 O28",
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}