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{
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{
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{
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"structure_string": "Nd1 Si2 Rh3\n1.0\n2.798878 -4.847799 0.000000\n2.798878 4.847799 0.000000\n0.000000 0.000000 3.687128\nNd Si Rh\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Nd\n0.666667 0.333333 0.000000 Si\n0.333333 0.666667 0.000000 Si\n0.500000 0.000000 0.500000 Rh\n0.000000 0.500000 0.500000 Rh\n0.500000 0.500000 0.500000 Rh\n",
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{
"id": "mp-1203960",
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"structure_string": "U4 H24 Br8 O20\n1.0\n6.708283 0.000000 0.000000\n0.000000 9.936669 0.000000\n0.000000 0.311678 12.884425\nU H Br O\n4 24 8 20\ndirect\n0.084550 0.750789 0.920417 U\n0.584550 0.249211 0.579583 U\n0.915450 0.249211 0.079583 U\n0.415450 0.750789 0.420417 U\n0.747932 0.956824 0.968469 H\n0.247932 0.043176 0.531531 H\n0.252068 0.043176 0.031531 H\n0.752068 0.956824 0.468469 H\n0.711917 0.915787 0.853064 H\n0.211917 0.084213 0.646936 H\n0.288083 0.084213 0.146936 H\n0.788083 0.915787 0.353064 H\n0.222923 0.546964 0.083829 H\n0.722923 0.453036 0.416171 H\n0.777077 0.453036 0.916171 H\n0.277077 0.546964 0.583829 H\n0.351606 0.680608 0.107956 H\n0.851606 0.319392 0.392044 H\n0.648394 0.319392 0.892044 H\n0.148394 0.680608 0.607956 H\n0.993888 0.743206 0.158428 H\n0.493888 0.256794 0.341572 H\n0.006112 0.256794 0.841572 H\n0.506112 0.743206 0.658428 H\n0.788855 0.796673 0.114872 H\n0.288855 0.203327 0.385128 H\n0.211145 0.203327 0.885128 H\n0.711145 0.796673 0.614872 H\n0.405203 0.636625 0.810195 Br\n0.905203 0.363375 0.689805 Br\n0.594797 0.363375 0.189805 Br\n0.094797 0.636625 0.310195 Br\n0.004130 0.849089 0.707077 Br\n0.504130 0.150911 0.792923 Br\n0.995870 0.150911 0.292923 Br\n0.495870 0.849089 0.207077 Br\n0.764208 0.882186 0.919743 O\n0.264208 0.117814 0.580257 O\n0.235792 0.117814 0.080257 O\n0.735792 0.882186 0.419743 O\n0.938341 0.600344 0.903273 O\n0.438341 0.399656 0.596727 O\n0.061659 0.399656 0.096727 O\n0.561659 0.600344 0.403273 O\n0.228309 0.900934 0.946683 O\n0.728309 0.099066 0.553317 O\n0.771691 0.099066 0.053317 O\n0.271691 0.900934 0.446683 O\n0.269097 0.635221 0.055502 O\n0.769097 0.364779 0.444498 O\n0.730903 0.364779 0.944498 O\n0.230903 0.635221 0.555502 O\n0.929158 0.781616 0.095229 O\n0.429158 0.218384 0.404771 O\n0.070842 0.218384 0.904771 O\n0.570842 0.781616 0.595229 O\n",
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"formula_full": "U4 H24 Br8 O20",
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"spacegroup": 14
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{
"id": "mp-867537",
"created_at": "2022-09-04T14:44:28.001540Z",
"structure_string": "Li4 Co3 Ni1 O8\n1.0\n5.016121 -2.855108 0.000000\n5.016121 2.855108 0.000000\n3.391033 0.000000 4.670547\nLi Co Ni O\n4 3 1 8\ndirect\n0.500000 0.000000 0.000000 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.500000 Li\n0.500000 0.500000 0.000000 Co\n0.500000 0.000000 0.500000 Co\n0.000000 0.500000 0.500000 Co\n0.000000 0.000000 0.000000 Ni\n0.730476 0.244797 0.244797 O\n0.755203 0.755203 0.269524 O\n0.260876 0.260876 0.260876 O\n0.755203 0.269524 0.755203 O\n0.244797 0.730476 0.244797 O\n0.739124 0.739124 0.739124 O\n0.244797 0.244797 0.730476 O\n0.269524 0.755203 0.755203 O\n",
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"formula_full": "Li4 Co3 Ni1 O8",
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{
"id": "mp-781707",
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"structure_string": "La16 Al8 O36\n1.0\n11.077166 0.000000 0.000000\n0.000000 7.941204 0.000000\n0.000000 3.883463 10.963992\nLa Al O\n16 8 36\ndirect\n0.629912 0.910364 0.933672 La\n0.870088 0.910364 0.433672 La\n0.411642 0.777082 0.690617 La\n0.900549 0.728500 0.795280 La\n0.088358 0.777082 0.190617 La\n0.121312 0.584460 0.584753 La\n0.599451 0.728500 0.295280 La\n0.621312 0.415540 0.915247 La\n0.378688 0.584460 0.084753 La\n0.400549 0.271500 0.704720 La\n0.878688 0.415540 0.415247 La\n0.911642 0.222918 0.809383 La\n0.099451 0.271500 0.204720 La\n0.588358 0.222918 0.309383 La\n0.129912 0.089636 0.566328 La\n0.370088 0.089636 0.066328 La\n0.182228 0.964217 0.874948 Al\n0.317772 0.964217 0.374948 Al\n0.687387 0.597555 0.620907 Al\n0.187387 0.402445 0.879093 Al\n0.812613 0.597555 0.120907 Al\n0.312613 0.402445 0.379093 Al\n0.682228 0.035783 0.625052 Al\n0.817772 0.035783 0.125052 Al\n0.026102 0.939511 0.850837 O\n0.266376 0.974953 0.740977 O\n0.000522 0.830310 0.606971 O\n0.717334 0.820117 0.617223 O\n0.498786 0.687352 0.893900 O\n0.473898 0.939511 0.350837 O\n0.233624 0.974953 0.240977 O\n0.764058 0.614997 0.971580 O\n0.263807 0.827492 0.519105 O\n0.279835 0.522626 0.753426 O\n0.499478 0.830310 0.106971 O\n0.782666 0.820117 0.117223 O\n0.037602 0.470285 0.830299 O\n0.001214 0.687352 0.393900 O\n0.537602 0.529715 0.669701 O\n0.735942 0.614997 0.471580 O\n0.779835 0.477374 0.746574 O\n0.236193 0.827492 0.019105 O\n0.763807 0.172508 0.980895 O\n0.220165 0.522626 0.253426 O\n0.264058 0.385003 0.528420 O\n0.462398 0.470285 0.330299 O\n0.998786 0.312648 0.606100 O\n0.962398 0.529715 0.169701 O\n0.217334 0.179883 0.882777 O\n0.500522 0.169690 0.893029 O\n0.720165 0.477374 0.246574 O\n0.736193 0.172508 0.480895 O\n0.235942 0.385003 0.028420 O\n0.766376 0.025047 0.759023 O\n0.526102 0.060489 0.649163 O\n0.501214 0.312648 0.106100 O\n0.282666 0.179883 0.382777 O\n0.999478 0.169690 0.393029 O\n0.733624 0.025047 0.259023 O\n0.973898 0.060489 0.149163 O\n",
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{
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},
{
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],
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{
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"structure_string": "Sr3 Y1 Co2 O8\n1.0\n2.705663 -6.213494 0.000000\n2.705663 6.213494 0.000000\n0.000000 0.000000 5.373127\nSr Y Co O\n3 1 2 8\ndirect\n0.644996 0.355004 0.000000 Sr\n0.357107 0.642893 0.000000 Sr\n0.855128 0.144872 0.500000 Sr\n0.135127 0.864873 0.500000 Y\n0.502148 0.497852 0.500000 Co\n0.000208 0.999792 0.000000 Co\n0.846882 0.153118 0.000000 O\n0.315894 0.684106 0.500000 O\n0.662678 0.337322 0.500000 O\n0.157794 0.842206 0.000000 O\n0.764885 0.753865 0.743742 O\n0.246135 0.235115 0.256258 O\n0.246135 0.235115 0.743742 O\n0.764885 0.753865 0.256258 O\n",
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],
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"volume": 180.6619474460328,
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"formula_full": "Sr3 Y1 Co2 O8",
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"spacegroup": 38
},
{
"id": "mp-766493",
"created_at": "2022-09-04T14:44:27.095752Z",
"structure_string": "Mn21 O40\n1.0\n-6.553444 6.553444 4.176498\n6.553444 -6.553444 4.176498\n6.553444 6.553444 -4.176498\nMn O\n21 40\ndirect\n0.777404 0.828703 0.355065 Mn\n0.173863 0.023515 0.448696 Mn\n0.979752 0.929322 0.151375 Mn\n0.777947 0.828377 0.848625 Mn\n0.500000 0.500000 0.000000 Mn\n0.171623 0.020248 0.949570 Mn\n0.473638 0.422339 0.644935 Mn\n0.878946 0.624824 0.253033 Mn\n0.374087 0.121054 0.745878 Mn\n0.577661 0.222596 0.051299 Mn\n0.775525 0.324263 0.350523 Mn\n0.675737 0.026259 0.451262 Mn\n0.574997 0.224475 0.548738 Mn\n0.274832 0.826137 0.849652 Mn\n0.976485 0.425180 0.150348 Mn\n0.171297 0.526362 0.948701 Mn\n0.375176 0.628209 0.254122 Mn\n0.973741 0.425003 0.649477 Mn\n0.371791 0.625913 0.746967 Mn\n0.070678 0.222053 0.050430 Mn\n0.574820 0.725168 0.551304 Mn\n0.535240 0.604301 0.356383 O\n0.015608 0.047470 0.345165 O\n0.844548 0.976363 0.043925 O\n0.199377 0.155452 0.131814 O\n0.023637 0.067563 0.868186 O\n0.930265 0.785832 0.433153 O\n0.352678 0.497112 0.566847 O\n0.527129 0.583480 0.830484 O\n0.752996 0.696645 0.169516 O\n0.420068 0.263329 0.465433 O\n0.103658 0.870964 0.256573 O\n0.702305 0.670444 0.654835 O\n0.932437 0.800623 0.956075 O\n0.247918 0.178857 0.643617 O\n0.814332 0.446523 0.543476 O\n0.416520 0.247004 0.943650 O\n0.647786 0.378375 0.243694 O\n0.553477 0.096953 0.367808 O\n0.595907 0.352214 0.730589 O\n0.821143 0.464760 0.069061 O\n0.998744 0.552665 0.333597 O\n0.329556 0.984392 0.031862 O\n0.152914 0.896342 0.767306 O\n0.903047 0.270855 0.456524 O\n0.334853 0.001256 0.553922 O\n0.502888 0.069735 0.855566 O\n0.736671 0.202105 0.156739 O\n0.214168 0.647322 0.144434 O\n0.447335 0.780932 0.446078 O\n0.045365 0.579932 0.843261 O\n0.729145 0.185668 0.632192 O\n0.129036 0.385609 0.232694 O\n0.219068 0.665147 0.666403 O\n0.395699 0.752082 0.930939 O\n0.952530 0.297695 0.968138 O\n0.621625 0.865318 0.269411 O\n0.797895 0.954635 0.534567 O\n0.303355 0.472871 0.056350 O\n0.134682 0.404093 0.756306 O\n0.614391 0.847086 0.743427 O\n",
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]
}