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{
"id": "jvasp-42914",
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"structure_string": "Li2 V4 Si4 O16\n1.0\n0.000000 5.680002 -0.000015\n5.729154 0.000000 0.000000\n0.000000 -0.000022 -7.937244\nLi V Si O\n2 4 4 16\ndirect\n0.685738 0.500000 0.249998 Li\n0.314262 0.500000 0.750000 Li\n0.000000 0.273491 0.000000 V\n0.000000 0.726507 0.500000 V\n0.721385 0.000000 0.249999 V\n0.278615 0.000000 0.749999 V\n0.238859 0.755702 0.121136 Si\n0.238859 0.244296 0.378865 Si\n0.761141 0.244296 0.621134 Si\n0.761141 0.755702 0.878863 Si\n0.485166 0.233172 0.272271 O\n0.228843 0.008222 0.505217 O\n0.228844 0.991776 0.994783 O\n0.230174 0.513557 0.010281 O\n0.230174 0.486441 0.489720 O\n0.485165 0.766828 0.227729 O\n0.514835 0.766828 0.772270 O\n0.771157 0.008222 0.494782 O\n0.769826 0.513557 0.989718 O\n0.769826 0.486441 0.510279 O\n0.771156 0.991776 0.005216 O\n0.003780 0.237382 0.248179 O\n0.996221 0.762617 0.748179 O\n0.996220 0.237382 0.751819 O\n0.514834 0.233172 0.727728 O\n0.003779 0.762617 0.251820 O\n",
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{
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"structure_string": "K4 Na2 B2 P4\n1.0\n4.837111 0.000152 1.166706\n2.406000 6.227209 0.636229\n-0.014431 0.025830 10.670751\nK Na B P\n4 2 2 4\ndirect\n0.982863 0.855811 0.178500 K\n0.177050 0.236705 0.409191 K\n0.017137 0.144189 0.821500 K\n0.822950 0.763295 0.590809 K\n0.297854 0.537328 0.866905 Na\n0.702146 0.462672 0.133096 Na\n0.500000 0.500000 0.500000 B\n0.500000 -0.000000 0.000000 B\n0.334593 0.240299 0.090612 P\n0.466766 0.693842 0.372671 P\n0.665407 0.759701 0.909388 P\n0.533234 0.306158 0.627329 P\n",
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{
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"structure_string": "Fe1 Ni2 C6 N6\n1.0\n6.134035 0.000000 3.541487\n2.044678 5.783224 3.541487\n-0.000000 0.000000 7.082974\nFe Ni C N\n1 2 6 6\ndirect\n0.000000 0.000000 0.000000 Fe\n0.250000 0.250000 0.250000 Ni\n0.500001 0.500000 0.500000 Ni\n0.187869 0.812131 0.187869 C\n0.812132 0.187868 0.812131 C\n0.187869 0.812131 0.812132 C\n0.812132 0.187868 0.187868 C\n0.187868 0.187868 0.812131 C\n0.812133 0.812131 0.187869 C\n0.304727 0.695273 0.695273 N\n0.695274 0.304727 0.695273 N\n0.304727 0.695273 0.304727 N\n0.695274 0.304727 0.304727 N\n0.304727 0.304727 0.695273 N\n0.695274 0.695273 0.304727 N\n",
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{
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"created_at": "2022-09-04T14:37:12.177180Z",
"updated_at": "2022-09-04T14:37:12.177205Z",
"structure_string": "Cu2 H8 I4 O16\n1.0\n6.644135 0.000000 -0.037423\n0.000000 4.763873 0.000000\n-2.602910 0.000000 11.002504\nCu H I O\n2 8 4 16\ndirect\n-0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.181526 0.587029 0.923274 H\n0.181526 0.912970 0.423275 H\n0.344970 0.761469 0.537827 H\n0.655031 0.261469 0.962173 H\n0.344970 0.738531 0.037827 H\n0.655031 0.238531 0.462173 H\n0.818473 0.087029 0.576725 H\n0.818473 0.412970 0.076726 H\n0.738630 0.870919 0.234178 I\n0.738630 0.629080 0.734177 I\n0.261370 0.129080 0.765822 I\n0.261370 0.370919 0.265822 I\n0.485620 0.155813 0.340507 O\n0.928877 0.819982 0.666794 O\n0.785012 0.710520 0.386899 O\n0.772694 0.273331 0.536487 O\n0.514380 0.655813 0.159493 O\n0.785012 0.789480 0.886899 O\n0.514380 0.844186 0.659493 O\n0.071122 0.319983 0.833206 O\n0.485620 0.344186 0.840507 O\n0.227305 0.726668 0.463512 O\n0.214987 0.289480 0.613101 O\n0.071122 0.180017 0.333206 O\n0.227305 0.773331 0.963512 O\n0.772694 0.226668 0.036488 O\n0.214987 0.210520 0.113101 O\n0.928877 0.680017 0.166794 O\n",
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{
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"created_at": "2022-09-04T14:37:13.711821Z",
"updated_at": "2022-09-04T14:37:13.711845Z",
"structure_string": "Te2 W4 Se4 S2\n1.0\n3.347321 -0.000000 -0.000000\n-1.673661 2.898884 0.000056\n-0.000000 0.001668 36.133835\nTe W Se S\n2 4 4 2\ndirect\n0.666681 0.333362 0.415211 Te\n0.666636 0.333271 0.521012 Te\n0.333312 0.666624 0.098512 W\n0.333330 0.666661 0.468126 W\n0.666671 0.333340 0.274759 W\n0.666684 0.333369 0.661546 W\n0.333336 0.666672 0.321123 Se\n0.333351 0.666702 0.707858 Se\n0.333349 0.666700 0.228391 Se\n0.333364 0.666729 0.615158 Se\n0.666666 0.333331 0.056326 S\n0.666618 0.333235 0.140727 S\n",
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{
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"created_at": "2022-09-04T14:37:07.046539Z",
"updated_at": "2022-09-04T14:37:07.046568Z",
"structure_string": "K2 Rb1 Y1 F6\n1.0\n5.833346 -0.000000 3.367884\n1.944449 5.499731 3.367884\n-0.000000 -0.000000 6.735768\nK Rb Y F\n2 1 1 6\ndirect\n0.750001 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500001 0.500000 0.499999 Rb\n0.000000 0.000000 0.000000 Y\n0.773159 0.226841 0.226840 F\n0.226841 0.226841 0.773159 F\n0.226842 0.773159 0.773158 F\n0.226842 0.773159 0.226841 F\n0.773159 0.226841 0.773158 F\n0.773160 0.773159 0.226840 F\n",
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{
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"created_at": "2022-09-04T14:37:27.282385Z",
"updated_at": "2022-09-04T14:37:27.282408Z",
"structure_string": "Li3 Co1 Cu4 O8\n1.0\n-0.263642 2.882820 -5.568844\n1.363508 -2.553626 -5.568844\n-4.977591 1.471918 -3.039828\nLi Co Cu O\n3 1 4 8\ndirect\n0.000000 -0.000000 0.500000 Li\n0.500000 -0.000000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.500000 0.500000 -0.000000 Co\n-0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.500000 -0.000000 -0.000000 Cu\n-0.000000 0.500000 -0.000000 Cu\n0.467378 0.299816 0.832437 O\n0.985709 0.238590 0.713775 O\n0.524814 0.699485 0.713775 O\n0.963275 0.795851 0.832575 O\n0.036724 0.204149 0.167424 O\n0.475185 0.300515 0.286224 O\n0.014291 0.761410 0.286224 O\n0.532621 0.700183 0.167562 O\n",
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{
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"created_at": "2022-09-04T14:38:11.603394Z",
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"structure_string": "Li4 V3 Si1 O10\n1.0\n5.077964 0.018410 0.009669\n0.008896 6.014730 0.011295\n-2.518573 -0.059584 7.711640\nLi V Si O\n4 3 1 10\ndirect\n0.020759 0.345540 0.889209 Li\n0.628755 0.356391 0.125609 Li\n0.136546 0.659790 0.113270 Li\n0.523249 0.654031 0.899509 Li\n0.438247 0.158711 0.721714 V\n0.207257 0.158731 0.283818 V\n0.931039 0.834163 0.705736 V\n0.708867 0.845605 0.276542 Si\n0.767313 0.765846 0.479281 O\n0.887212 0.652563 0.858213 O\n0.528894 0.665446 0.140729 O\n0.025440 0.347845 0.133416 O\n0.806235 0.108635 0.749865 O\n0.256680 0.239996 0.502445 O\n0.549287 0.093781 0.252190 O\n0.298255 0.882012 0.749367 O\n0.397947 0.341486 0.876663 O\n0.012023 0.889434 0.242420 O\n",
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"structure_string": "Ga2 H10 N4 F4\n1.0\n-0.000000 5.909071 0.000000\n-5.422027 2.954535 -0.165196\n0.140043 0.000000 4.962544\nGa H N F\n2 10 4 4\ndirect\n0.500000 0.000000 0.500000 Ga\n0.000000 0.000000 0.000000 Ga\n0.888656 0.222687 0.570030 H\n0.952037 0.390014 0.795043 H\n0.365325 0.269349 0.923232 H\n0.270883 0.458235 0.656164 H\n0.657950 0.390014 0.795043 H\n0.634675 0.730652 0.076766 H\n0.342050 0.609987 0.204956 H\n0.047964 0.609987 0.204956 H\n0.111344 0.777314 0.429969 H\n0.729117 0.541766 0.343835 H\n0.642025 0.715952 0.280066 N\n0.144560 0.710880 0.231360 N\n0.855440 0.289121 0.768638 N\n0.357975 0.284049 0.719932 N\n0.157906 0.157442 0.241453 F\n0.315348 0.842559 0.758545 F\n0.842094 0.842559 0.758545 F\n0.684652 0.157442 0.241453 F\n",
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}