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{
"id": "jvasp-100459",
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{
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"structure_string": "Ba2 Y1 Ru1 O6\n1.0\n5.143516 0.000000 2.969610\n1.714505 4.849354 2.969610\n0.000000 0.000000 5.939221\nBa Y Ru O\n2 1 1 6\ndirect\n0.750001 0.749999 0.749999 Ba\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Y\n0.500001 0.500000 0.500000 Ru\n0.265292 0.734709 0.734709 O\n0.265292 0.734709 0.265290 O\n0.734710 0.265290 0.734709 O\n0.265291 0.265290 0.734709 O\n0.734710 0.265290 0.265290 O\n0.734711 0.734709 0.265290 O\n",
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{
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"structure_string": "Na2 Cu1 Pd1 F6\n1.0\n5.027530 -0.000000 2.902645\n1.675844 4.740000 2.902645\n0.000000 -0.000000 5.805291\nNa Cu Pd F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750001 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500001 Cu\n0.000000 0.000000 0.000000 Pd\n0.743560 0.256440 0.256441 F\n0.256440 0.256440 0.743560 F\n0.256440 0.743560 0.743561 F\n0.256440 0.743560 0.256441 F\n0.743560 0.256440 0.743561 F\n0.743559 0.743560 0.256442 F\n",
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"structure_string": "Li4 Fe6 Ni2 O16\n1.0\n5.582607 0.000002 0.000047\n-2.791302 4.834675 -0.000096\n0.000124 -0.000215 9.383512\nLi Fe Ni O\n4 6 2 16\ndirect\n0.333332 0.666682 0.896407 Li\n0.000081 0.000050 0.995486 Li\n0.999918 0.999968 0.495486 Li\n0.666667 0.333349 0.396407 Li\n0.826561 0.653151 0.713177 Fe\n0.346821 0.173421 0.713166 Fe\n0.826562 0.173427 0.713175 Fe\n0.173438 0.346865 0.213174 Fe\n0.173439 0.826591 0.213177 Fe\n0.653179 0.826601 0.213166 Fe\n0.333303 0.666662 0.490519 Ni\n0.666696 0.333358 0.990519 Ni\n0.322911 0.161462 0.105024 O\n0.838605 0.677166 0.104999 O\n0.666645 0.333326 0.598991 O\n0.517352 0.034746 0.836366 O\n0.517358 0.482636 0.836368 O\n0.677089 0.838551 0.605023 O\n0.482647 0.517394 0.336366 O\n0.034737 0.517383 0.336363 O\n0.161402 0.322855 0.605002 O\n0.999996 0.000013 0.808878 O\n0.000002 0.000017 0.308877 O\n0.333355 0.666682 0.098991 O\n0.965263 0.482644 0.836363 O\n0.161396 0.838562 0.604999 O\n0.482642 0.965279 0.336368 O\n0.838598 0.161453 0.105002 O\n",
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{
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"created_at": "2022-09-04T14:37:29.369098Z",
"updated_at": "2022-09-04T14:37:29.369124Z",
"structure_string": "Nd6 Cu2 Sn2 S14\n1.0\n5.073478 -8.787522 -0.000000\n5.073478 8.787522 -0.000000\n0.000000 0.000000 6.096970\nNd Cu Sn S\n6 2 2 14\ndirect\n0.781108 0.642174 0.260367 Nd\n0.861066 0.218893 0.260367 Nd\n0.218893 0.357827 0.760367 Nd\n0.642174 0.861066 0.760367 Nd\n0.138934 0.781108 0.760367 Nd\n0.357827 0.138934 0.260367 Nd\n0.000000 0.000000 0.702103 Cu\n0.000000 0.000000 0.202103 Cu\n0.666667 0.333333 0.832564 Sn\n0.333333 0.666667 0.332564 Sn\n0.154138 0.256446 0.219858 S\n0.483985 0.570060 0.504690 S\n0.102308 0.845862 0.219858 S\n0.256446 0.102308 0.719858 S\n0.666667 0.333333 0.442587 S\n0.333333 0.666667 0.942587 S\n0.897693 0.154138 0.719858 S\n0.429941 0.913925 0.504690 S\n0.743554 0.897693 0.219858 S\n0.516016 0.429941 0.004690 S\n0.570060 0.086076 0.004690 S\n0.913925 0.483985 0.004690 S\n0.086075 0.516016 0.504690 S\n0.845862 0.743554 0.719858 S\n",
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{
"id": "jvasp-45374",
"created_at": "2022-09-04T14:37:09.241268Z",
"updated_at": "2022-09-04T14:37:09.241281Z",
"structure_string": "Sr4 Al6 Te1 O12\n1.0\n7.716888 0.000000 -2.728332\n-3.858445 6.683021 -2.728332\n0.000000 0.000000 8.184996\nSr Al Te O\n4 6 1 12\ndirect\n0.408448 0.408448 0.408449 Sr\n0.591552 -0.000000 0.000000 Sr\n-0.000000 -0.000000 0.591552 Sr\n0.000000 0.591552 0.000000 Sr\n0.750000 0.500000 0.250001 Al\n0.250000 0.500000 0.750001 Al\n0.750000 0.250000 0.500001 Al\n0.250000 0.750000 0.500001 Al\n0.500000 0.750000 0.250001 Al\n0.500000 0.250000 0.750001 Al\n0.000000 0.000000 0.000000 Te\n0.305102 0.688273 0.305102 O\n0.000000 0.694898 0.383172 O\n0.694899 0.383172 0.000000 O\n0.383172 0.694898 0.000000 O\n0.616829 0.616828 0.311727 O\n0.383172 -0.000000 0.694899 O\n0.000000 0.383172 0.694899 O\n0.311727 0.616828 0.616829 O\n0.616828 0.311727 0.616829 O\n0.305102 0.305101 0.688274 O\n0.688274 0.305101 0.305102 O\n0.694899 -0.000000 0.383172 O\n",
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{
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"structure_string": "K2 Ge1 I6 O18\n1.0\n7.409135 -0.023387 -0.888455\n-0.998592 7.341570 -0.888455\n-0.020486 -0.023387 7.462186\nK Ge I O\n2 1 6 18\ndirect\n0.326580 0.326580 0.326581 K\n0.673420 0.673419 0.673421 K\n0.000000 0.000000 0.000000 Ge\n0.794446 0.369102 0.160865 I\n0.839136 0.205554 0.630898 I\n0.160864 0.794445 0.369103 I\n0.205555 0.630897 0.839137 I\n0.630898 0.839136 0.205556 I\n0.369102 0.160864 0.794446 I\n0.184827 0.947985 0.182063 O\n0.423723 0.408704 0.814666 O\n0.794563 0.883521 0.416067 O\n0.185334 0.576276 0.591296 O\n0.052015 0.817937 0.815174 O\n0.182062 0.184826 0.947985 O\n0.815173 0.052015 0.817939 O\n0.205438 0.116478 0.583935 O\n0.576277 0.591295 0.185335 O\n0.416066 0.794562 0.883523 O\n0.591295 0.185334 0.576277 O\n0.814666 0.423723 0.408706 O\n0.947985 0.182062 0.184828 O\n0.583935 0.205437 0.116479 O\n0.116478 0.583934 0.205438 O\n0.817939 0.815173 0.052016 O\n0.883522 0.416065 0.794563 O\n0.408705 0.814665 0.423724 O\n",
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"structure_string": "Tb1 Mn2 Bi1 O6\n1.0\n5.196480 0.000000 3.000189\n1.732159 4.899280 3.000192\n0.000004 0.000005 6.000372\nTb Mn Bi O\n1 2 1 6\ndirect\n0.000000 0.999999 0.000000 Tb\n0.750007 0.750005 0.749994 Mn\n0.250005 0.250006 0.249996 Mn\n0.499999 0.500000 0.500001 Bi\n0.744331 0.255664 0.255669 O\n0.744331 0.255664 0.744337 O\n0.255662 0.744332 0.744336 O\n0.255664 0.744332 0.255668 O\n0.744332 0.744334 0.255666 O\n0.255663 0.255667 0.744333 O\n",
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{
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"updated_at": "2022-09-04T14:37:17.079166Z",
"structure_string": "Mg2 Bi2 P2 O12\n1.0\n0.000000 6.233951 0.149378\n5.206130 0.000000 0.000000\n0.000000 -2.849038 -7.369461\nMg Bi P O\n2 2 2 12\ndirect\n0.878826 0.250000 0.082847 Mg\n0.121173 0.750000 0.917153 Mg\n0.765741 0.750000 0.440843 Bi\n0.234258 0.250000 0.559156 Bi\n0.384502 0.250000 0.177928 P\n0.615497 0.750000 0.822071 P\n0.488339 0.750000 0.608786 O\n0.220000 0.016155 0.119597 O\n0.983197 0.476358 0.328553 O\n0.983197 0.023642 0.328553 O\n0.511660 0.250000 0.391213 O\n0.559111 0.250000 0.087699 O\n0.440888 0.750000 0.912301 O\n0.780000 0.983845 0.880402 O\n0.780000 0.516155 0.880402 O\n0.016802 0.976358 0.671447 O\n0.016802 0.523642 0.671447 O\n0.220000 0.483845 0.119597 O\n",
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{
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"structure_string": "Li4 Al4 Si4 O16\n1.0\n4.953094 0.000000 0.000000\n0.000000 6.582106 0.000000\n0.000000 0.000000 10.059460\nLi Al Si O\n4 4 4 16\ndirect\n0.255991 0.988741 0.350979 Li\n0.755991 0.488741 0.149021 Li\n0.755991 0.011260 0.649021 Li\n0.255991 0.511260 0.850979 Li\n0.751718 0.510799 0.672681 Al\n0.251719 0.010799 0.827319 Al\n0.251719 0.489202 0.327319 Al\n0.751718 0.989202 0.172681 Al\n0.750801 0.726936 0.408780 Si\n0.750801 0.773065 0.908780 Si\n0.250802 0.226936 0.091220 Si\n0.250802 0.273064 0.591220 Si\n0.313116 0.226772 0.931167 O\n0.358325 0.061840 0.661339 O\n0.858325 0.938160 0.338661 O\n0.358325 0.438160 0.161339 O\n0.313116 0.273228 0.431167 O\n0.858325 0.561841 0.838661 O\n0.400324 0.461919 0.668712 O\n0.900323 0.961919 0.831288 O\n0.813116 0.726772 0.568833 O\n0.900323 0.538081 0.331288 O\n0.424122 0.710704 0.380177 O\n0.924122 0.289297 0.619823 O\n0.924122 0.210704 0.119823 O\n0.400324 0.038081 0.168712 O\n0.424122 0.789297 0.880177 O\n0.813116 0.773229 0.068833 O\n",
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}