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{
"id": "jvasp-110847",
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{
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"structure_string": "Li6 Mn5 Co1 O12\n1.0\n5.044339 -0.009975 0.198739\n-2.161245 -4.561866 -0.127897\n-1.482593 0.414646 -10.199827\nLi Mn Co O\n6 5 1 12\ndirect\n0.718158 0.976039 0.214454 Li\n0.056461 0.653042 0.219616 Li\n0.626907 0.698836 0.786365 Li\n0.281842 0.023960 0.785547 Li\n0.373092 0.301163 0.213636 Li\n0.943539 0.346957 0.780385 Li\n0.669337 0.332876 0.000194 Mn\n0.831447 0.668402 0.500012 Mn\n0.500000 -0.000001 0.500000 Mn\n0.330662 0.667123 0.999806 Mn\n0.168553 0.331597 0.499989 Mn\n0.000000 0.000000 0.000000 Co\n0.759379 0.962599 0.396003 O\n0.996654 0.296519 0.116863 O\n0.863968 0.332777 0.592909 O\n0.666381 0.042872 0.884444 O\n0.333619 0.957127 0.115557 O\n0.427453 0.293385 0.395851 O\n0.660449 0.620487 0.116877 O\n0.339551 0.379512 0.883123 O\n0.572547 0.706614 0.604150 O\n0.240621 0.037401 0.603997 O\n0.136032 0.667222 0.407092 O\n0.003345 0.703481 0.883137 O\n",
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{
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"structure_string": "Ti6 Rh10\n1.0\n4.115309 0.000000 0.000000\n0.000000 5.406275 -0.000000\n0.000000 0.000000 10.503051\nTi Rh\n6 10\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.500000 0.500000 Ti\n0.500000 0.339239 0.144010 Ti\n0.500000 0.660762 0.855990 Ti\n0.500000 0.839239 0.355990 Ti\n0.500000 0.160762 0.644010 Ti\n0.000000 0.000000 0.500000 Rh\n0.000000 0.500000 0.000000 Rh\n0.000000 0.102288 0.235887 Rh\n0.000000 0.897713 0.764113 Rh\n0.000000 0.602288 0.264113 Rh\n0.000000 0.397713 0.735887 Rh\n0.500000 0.312395 0.393164 Rh\n0.500000 0.687606 0.606836 Rh\n0.500000 0.812395 0.106836 Rh\n0.500000 0.187606 0.893164 Rh\n",
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{
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"created_at": "2022-09-04T14:37:34.218577Z",
"updated_at": "2022-09-04T14:37:34.218603Z",
"structure_string": "K2 Ge2 Pb2 O7\n1.0\n2.909113 -5.038731 -0.000000\n2.909112 5.038731 -0.000000\n-0.000000 0.000000 7.970772\nK Ge Pb O\n2 2 2 7\ndirect\n0.666667 0.333333 0.928880 K\n0.333333 0.666667 0.071120 K\n0.000000 0.000000 0.272741 Ge\n0.000000 0.000000 0.727259 Ge\n0.333333 0.666667 0.616892 Pb\n0.666667 0.333333 0.383108 Pb\n0.771578 0.099374 0.207614 O\n0.228421 0.900625 0.792386 O\n0.327797 0.228421 0.207614 O\n0.000000 0.000000 0.500000 O\n0.099374 0.327797 0.792386 O\n0.900625 0.672202 0.207614 O\n0.672203 0.771578 0.792386 O\n",
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{
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"updated_at": "2022-09-04T14:35:52.274624Z",
"structure_string": "Te2 Mo1 W1 S2\n1.0\n3.361517 0.000002 0.000001\n-1.680756 2.911130 0.000010\n0.000007 0.000080 23.878385\nTe Mo W S\n2 1 1 2\ndirect\n0.333352 0.666706 0.530501 Te\n0.333356 0.666713 0.372258 Te\n0.666691 0.333380 0.451445 Mo\n0.333311 0.666622 0.150406 W\n0.666646 0.333292 0.086807 S\n0.666643 0.333284 0.214186 S\n",
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{
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"created_at": "2022-09-04T14:38:05.481203Z",
"updated_at": "2022-09-04T14:38:05.481230Z",
"structure_string": "Na2 Ga2 Ge4 O12\n1.0\n0.062123 0.000000 5.487899\n-4.789826 4.429335 1.447863\n-4.789826 -4.429335 1.447863\nNa Ga Ge O\n2 2 4 12\ndirect\n0.749999 0.691827 0.308174 Na\n0.249999 0.308174 0.691827 Na\n0.749999 0.093974 0.906028 Ga\n0.249999 0.906027 0.093974 Ga\n0.725803 0.614722 0.808779 Ge\n0.774195 0.191223 0.385280 Ge\n0.274195 0.385279 0.191223 Ge\n0.225803 0.808778 0.614722 Ge\n0.010069 0.337617 0.388185 O\n0.489929 0.611816 0.662384 O\n0.125634 0.979249 0.814406 O\n0.374365 0.185595 0.020752 O\n0.874365 0.020753 0.185595 O\n0.676659 0.085225 0.634067 O\n0.323339 0.914776 0.365934 O\n0.176659 0.634067 0.085225 O\n0.510069 0.388185 0.337618 O\n0.823339 0.365934 0.914776 O\n0.625634 0.814406 0.979249 O\n-0.010071 0.662384 0.611816 O\n",
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{
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"created_at": "2022-09-04T14:38:00.297274Z",
"updated_at": "2022-09-04T14:38:00.297284Z",
"structure_string": "Rb2 Sr2 Si2 H2 O8\n1.0\n0.000000 5.813139 -0.039090\n7.840167 0.000000 0.000000\n0.000000 -2.868135 -5.106850\nRb Sr Si H O\n2 2 2 2 8\ndirect\n0.359128 0.231445 0.718891 Rb\n0.640871 0.731445 0.281109 Rb\n0.010241 0.486746 0.006376 Sr\n0.989759 0.986746 0.993624 Sr\n0.687779 0.245461 0.374870 Si\n0.312220 0.745461 0.625130 Si\n0.507023 0.004609 0.461548 H\n0.492977 0.504609 0.538452 H\n0.853380 0.237713 0.214855 O\n0.146619 0.737713 0.785145 O\n0.876210 0.240896 0.692914 O\n0.123790 0.740896 0.307087 O\n0.474601 0.403032 0.286840 O\n0.525399 0.903032 0.713160 O\n0.489675 0.067100 0.299940 O\n0.510324 0.567100 0.700060 O\n",
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{
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"created_at": "2022-09-04T14:37:27.531807Z",
"updated_at": "2022-09-04T14:37:27.531844Z",
"structure_string": "Rb1 Sr3\n1.0\n-0.000000 4.888298 4.888298\n4.888298 -0.000000 4.888298\n4.888298 4.888298 0.000000\nRb Sr\n1 3\ndirect\n0.750000 0.750000 0.750000 Rb\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.250000 0.250000 0.250000 Sr\n",
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{
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"created_at": "2022-09-04T14:35:49.346757Z",
"updated_at": "2022-09-04T14:35:49.346783Z",
"structure_string": "Ce6 O9\n1.0\n3.696850 0.000000 0.000000\n-1.848425 7.048734 -1.241473\n0.000000 0.016331 8.961683\nCe O\n6 9\ndirect\n0.366413 0.732826 0.511460 Ce\n0.312136 0.624271 0.861068 Ce\n0.633588 0.267174 0.488540 Ce\n0.034345 0.068689 0.813419 Ce\n0.965656 0.931310 0.186581 Ce\n0.687865 0.375729 0.138932 Ce\n0.796678 0.593354 0.372986 O\n0.128020 0.256040 0.285352 O\n0.527372 0.054746 0.657498 O\n0.203323 0.406646 0.627014 O\n0.176714 0.353428 0.972149 O\n0.823287 0.646572 0.027851 O\n0.472629 0.945254 0.342502 O\n0.500000 -0.000000 -0.000000 O\n0.871981 0.743959 0.714648 O\n",
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{
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"structure_string": "Sm4 V4 O12\n1.0\n5.367001 -0.000000 0.000000\n0.000000 5.653263 0.000000\n-0.000000 -0.000000 7.698989\nSm V O\n4 4 12\ndirect\n0.984150 0.437572 0.750000 Sm\n0.015850 0.562428 0.250000 Sm\n0.484150 0.062428 0.250000 Sm\n0.515850 0.937572 0.750000 Sm\n0.000000 0.000000 0.500000 V\n0.500000 0.500000 0.500000 V\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 -0.000000 V\n0.095814 0.029260 0.750000 O\n0.904186 0.970739 0.250000 O\n0.697749 0.201635 0.950609 O\n0.302251 0.798364 0.049391 O\n0.197749 0.298365 0.049391 O\n0.697749 0.201635 0.549391 O\n0.197749 0.298365 0.450609 O\n0.802251 0.701635 0.549391 O\n0.404186 0.529260 0.750000 O\n0.302251 0.798364 0.450609 O\n0.802251 0.701635 0.950609 O\n0.595814 0.470740 0.250000 O\n",
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{
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"structure_string": "Mn8 O13 F3\n1.0\n4.879947 0.002648 -0.008752\n0.032937 5.446930 -0.002649\n0.060244 0.111986 8.787662\nMn O F\n8 13 3\ndirect\n0.750204 0.169099 0.006185 Mn\n0.268145 0.860198 0.004344 Mn\n0.264914 0.357663 0.247316 Mn\n0.747854 0.663267 0.247530 Mn\n0.246862 0.852620 0.498254 Mn\n0.746598 0.108585 0.501066 Mn\n0.229149 0.357530 0.754305 Mn\n0.743794 0.646838 0.748867 Mn\n0.425346 0.122485 0.883797 O\n0.414311 0.618274 0.864098 O\n0.913346 0.391631 0.864751 O\n0.076184 0.608608 0.630283 O\n0.573114 0.874646 0.614301 O\n0.071296 0.104903 0.617262 O\n0.084419 0.620856 0.135721 O\n0.421828 0.106863 0.382545 O\n0.419046 0.616777 0.367531 O\n0.588650 0.395110 0.137782 O\n0.589217 0.893707 0.113788 O\n0.086827 0.123642 0.117262 O\n0.924290 0.878229 0.383374 O\n0.565150 0.359824 0.622209 F\n0.917385 0.371858 0.374399 F\n0.932076 0.896798 0.883027 F\n",
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{
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"created_at": "2022-09-04T14:36:10.841829Z",
"updated_at": "2022-09-04T14:36:10.841856Z",
"structure_string": "Sr4 H8 O8\n1.0\n9.881477 0.000000 0.000000\n0.000000 6.041737 0.000000\n0.000000 0.000000 3.912510\nSr H O\n4 8 8\ndirect\n0.658084 0.397896 0.250000 Sr\n0.158084 0.102104 0.250000 Sr\n0.338685 0.602125 0.750000 Sr\n0.838685 0.897876 0.750000 Sr\n0.523761 0.128443 0.750000 H\n0.023761 0.371557 0.750000 H\n0.972994 0.628503 0.250000 H\n0.472994 0.871498 0.250000 H\n0.090412 0.684044 0.750000 H\n0.406362 0.184078 0.250000 H\n0.906363 0.315922 0.250000 H\n0.590412 0.815957 0.750000 H\n0.122714 0.373912 0.750000 O\n0.892325 0.154038 0.250000 O\n0.392325 0.345962 0.250000 O\n0.104434 0.845930 0.750000 O\n0.604434 0.654071 0.750000 O\n0.874041 0.626055 0.250000 O\n0.374041 0.873946 0.250000 O\n0.622714 0.126088 0.750000 O\n",
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}
]
}