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{
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"structure_string": "Li3 Co3 Si3 O12\n1.0\n2.667442 -4.620146 -0.000000\n2.667442 4.620146 0.000000\n0.000000 0.000000 12.062891\nLi Co Si O\n3 3 3 12\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.000000 0.333333 Li\n0.000000 0.000000 0.666667 Li\n-0.000000 0.500000 0.833333 Co\n0.500000 0.500000 0.166667 Co\n0.500000 -0.000000 0.500000 Co\n-0.000000 0.500000 0.333333 Si\n0.500000 0.500000 0.666667 Si\n0.500000 -0.000000 0.000000 Si\n0.814060 0.608901 0.259130 O\n0.794840 0.608901 0.740870 O\n0.391098 0.185939 0.074204 O\n0.391098 0.205159 0.592463 O\n0.608901 0.794840 0.592463 O\n0.205159 0.814061 0.925796 O\n0.205159 0.391098 0.740870 O\n0.185939 0.391098 0.259130 O\n0.794841 0.185939 0.925796 O\n0.185939 0.794841 0.407537 O\n0.608901 0.814060 0.074204 O\n0.814061 0.205159 0.407537 O\n",
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{
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"structure_string": "Li5 Fe2 Cu3 O10\n1.0\n5.003388 0.109841 0.075073\n-1.364860 5.034597 -0.118012\n-1.763592 -2.302646 6.959572\nLi Fe Cu O\n5 2 3 10\ndirect\n0.206423 0.909805 0.399862 Li\n0.401094 0.282149 0.789297 Li\n0.500000 0.500000 0.500000 Li\n0.598907 0.717850 0.210703 Li\n0.793578 0.090194 0.600137 Li\n0.100068 0.677814 0.688786 Fe\n0.899933 0.322185 0.311213 Fe\n0.697333 0.884970 0.897474 Cu\n0.302667 0.115029 0.102525 Cu\n0.000000 0.500000 0.000000 Cu\n0.661747 0.339376 0.077117 O\n0.060802 0.017333 0.831057 O\n0.338253 0.660623 0.922882 O\n0.133704 0.325368 0.542811 O\n0.209948 0.528164 0.252304 O\n0.439028 0.874598 0.658977 O\n0.560972 0.125402 0.341022 O\n0.790052 0.471836 0.747696 O\n0.866297 0.674632 0.457188 O\n0.939198 0.982667 0.168942 O\n",
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{
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"updated_at": "2022-09-04T14:37:45.273810Z",
"structure_string": "Na1 Zr2 Cu1 F11\n1.0\n5.705389 0.259445 -0.620873\n-1.541571 4.874598 1.775214\n-2.174546 -0.684403 7.508187\nNa Zr Cu F\n1 2 1 11\ndirect\n0.000000 0.000000 0.000000 Na\n0.496419 0.512856 0.763821 Zr\n0.503581 0.487146 0.236179 Zr\n-0.000000 0.000000 0.500000 Cu\n0.328967 0.793854 0.118760 F\n0.150852 0.265127 0.650823 F\n0.807633 0.787958 0.727127 F\n0.671033 0.206148 0.881240 F\n0.292534 0.376057 -0.032922 F\n0.849148 0.734874 0.349177 F\n0.708085 0.183333 0.350936 F\n0.291915 0.816669 0.649064 F\n0.192367 0.212044 0.272872 F\n0.500000 0.500001 0.500000 F\n0.707466 0.623945 0.032922 F\n",
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{
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"created_at": "2022-09-04T14:37:43.111740Z",
"updated_at": "2022-09-04T14:37:43.111761Z",
"structure_string": "Al2 H24 Cl6 O12\n1.0\n7.819564 -0.148076 -1.089050\n-1.230817 7.723509 -1.089050\n-0.128790 -0.148076 7.893986\nAl H Cl O\n2 24 6 12\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.794232 0.392473 0.586845 H\n0.237506 0.279755 0.537867 H\n0.262493 0.962133 0.220244 H\n0.220244 0.262493 0.962133 H\n0.537867 0.237506 0.279756 H\n0.279755 0.537867 0.237507 H\n0.779755 0.737506 0.037867 H\n0.037867 0.779755 0.737507 H\n0.737506 0.037866 0.779756 H\n0.762493 0.720244 0.462133 H\n0.462132 0.762493 0.720245 H\n0.962132 0.220244 0.262493 H\n0.294233 0.086844 0.892474 H\n0.892473 0.294232 0.086844 H\n0.086844 0.892474 0.294233 H\n0.413155 0.205767 0.607527 H\n0.607526 0.413155 0.205767 H\n0.205767 0.607526 0.413156 H\n0.705766 0.913155 0.107526 H\n0.107526 0.705767 0.913156 H\n0.913155 0.107526 0.705767 H\n0.392473 0.586844 0.794233 H\n0.720244 0.462132 0.762494 H\n0.586844 0.794233 0.392474 H\n0.523024 0.976975 0.250000 Cl\n0.250000 0.523024 0.976975 Cl\n0.976974 0.249999 0.523025 Cl\n0.476975 0.023024 0.750000 Cl\n0.023025 0.750000 0.476975 Cl\n0.749999 0.476975 0.023025 Cl\n0.546553 0.367335 0.296176 O\n0.367335 0.296176 0.546554 O\n0.132665 0.953447 0.203824 O\n0.953446 0.203823 0.132665 O\n0.203824 0.132664 0.953447 O\n0.796175 0.867335 0.046553 O\n0.867334 0.046553 0.796176 O\n0.632664 0.703823 0.453447 O\n0.453446 0.632665 0.703824 O\n0.703823 0.453446 0.632665 O\n0.296176 0.546553 0.367335 O\n0.046553 0.796176 0.867335 O\n",
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"formula_full": "Al2 H24 Cl6 O12",
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{
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"created_at": "2022-09-04T14:37:57.886790Z",
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"structure_string": "K2 Na6 W2 O10\n1.0\n5.759876 0.006016 1.101424\n0.893357 5.690178 1.101424\n0.003676 0.003147 9.081838\nK Na W O\n2 6 2 10\ndirect\n0.749429 0.250572 0.499999 K\n0.250572 0.749429 0.499999 K\n0.648876 0.156822 0.888065 Na\n0.843180 0.351126 0.111934 Na\n0.351126 0.843180 0.111934 Na\n0.190288 0.190288 0.727891 Na\n0.156822 0.648875 0.888065 Na\n0.809713 0.809713 0.272108 Na\n0.308856 0.308856 0.259393 W\n0.691145 0.691145 0.740606 W\n0.902975 0.902974 0.748599 O\n0.254541 0.254541 0.468240 O\n0.745461 0.745461 0.531759 O\n0.444604 0.883543 0.845003 O\n0.097027 0.097027 0.251400 O\n0.477114 0.477114 0.741838 O\n0.883544 0.444604 0.845003 O\n0.116458 0.555397 0.154995 O\n0.522887 0.522887 0.258161 O\n0.555397 0.116458 0.154995 O\n",
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{
"id": "jvasp-46810",
"created_at": "2022-09-04T14:38:00.345188Z",
"updated_at": "2022-09-04T14:38:00.345211Z",
"structure_string": "Li2 Ni2 P2 O8\n1.0\n0.000000 5.556582 -0.000000\n2.858245 -2.778291 3.950957\n5.716490 0.000000 0.000000\nLi Ni P O\n2 2 2 8\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.000000 0.000000 Li\n0.000000 0.500000 0.000000 Ni\n0.000000 0.500000 0.500000 Ni\n0.369641 0.239280 0.380359 P\n0.630359 0.760721 0.619641 P\n0.260849 0.021698 0.263656 O\n0.739151 0.978303 0.285356 O\n0.260648 0.478590 0.260705 O\n0.717941 0.478590 0.260705 O\n0.260849 0.021698 0.714644 O\n0.739151 0.978303 0.736345 O\n0.282059 0.521411 0.739295 O\n0.739352 0.521411 0.739295 O\n",
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{
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"structure_string": "K2 Ag1 Bi1 Br6\n1.0\n6.885579 -0.000000 3.975391\n2.295193 6.491786 3.975391\n-0.000000 -0.000000 7.950782\nK Ag Bi Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Bi\n0.746455 0.253545 0.253545 Br\n0.253545 0.253545 0.746455 Br\n0.253544 0.746456 0.746455 Br\n0.253544 0.746456 0.253545 Br\n0.746455 0.253545 0.746455 Br\n0.746455 0.746456 0.253544 Br\n",
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"structure_string": "K2 Rb1 Ce1 Cl6\n1.0\n7.062406 0.000000 4.077482\n2.354135 6.658500 4.077482\n-0.000000 -0.000000 8.154963\nK Rb Ce Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Ce\n0.763490 0.236511 0.236509 Cl\n0.236511 0.236510 0.763489 Cl\n0.236510 0.763489 0.763489 Cl\n0.236510 0.763489 0.236511 Cl\n0.763490 0.236510 0.763489 Cl\n0.763490 0.763489 0.236509 Cl\n",
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{
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"structure_string": "Ce2 Cd2 As2 O2\n1.0\n4.139581 -0.000000 0.000000\n-0.000000 4.139581 0.000000\n-0.000000 0.000000 9.230650\nCe Cd As O\n2 2 2 2\ndirect\n0.500000 0.000000 0.873471 Ce\n0.000000 0.500000 0.126529 Ce\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.500000 Cd\n0.000000 0.500000 0.707195 As\n0.500000 0.000000 0.292805 As\n0.500000 0.500000 0.000000 O\n0.000000 0.000000 0.000000 O\n",
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{
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{
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"created_at": "2022-09-04T14:37:41.391142Z",
"updated_at": "2022-09-04T14:37:41.391163Z",
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{
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"structure_string": "K6 Lu2 Si4 O14\n1.0\n2.869925 -4.970855 -0.000000\n2.869925 4.970855 -0.000000\n0.000000 -0.000000 14.017978\nK Lu Si O\n6 2 4 14\ndirect\n0.666666 0.333332 0.909112 K\n0.333332 0.666666 0.090888 K\n0.666666 0.333332 0.590888 K\n0.333332 0.666666 0.409112 K\n0.000000 0.000000 0.750000 K\n0.000000 0.000000 0.250000 K\n0.000000 0.000000 0.000000 Lu\n0.000000 0.000000 0.500000 Lu\n0.333332 0.666666 0.631074 Si\n0.333332 0.666666 0.868926 Si\n0.666666 0.333332 0.368926 Si\n0.666666 0.333332 0.131074 Si\n0.177018 0.822980 0.594462 O\n0.177018 0.354039 0.905539 O\n0.666666 0.333332 0.250000 O\n0.354039 0.177018 0.094462 O\n0.645960 0.822980 0.594462 O\n0.822980 0.177018 0.405538 O\n0.177018 0.354039 0.594462 O\n0.177018 0.822980 0.905539 O\n0.822980 0.645960 0.094462 O\n0.645960 0.822980 0.905539 O\n0.822980 0.177018 0.094462 O\n0.354039 0.177018 0.405538 O\n0.822980 0.645960 0.405538 O\n0.333332 0.666666 0.750000 O\n",
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}