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{
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{
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{
"id": "mp-771120",
"created_at": "2022-09-04T14:40:19.903957Z",
"structure_string": "Li4 Ti3 Cr5 O16\n1.0\n2.960370 5.097284 0.000000\n-2.960370 5.097284 0.000000\n0.000000 0.039849 9.548847\nLi Ti Cr O\n4 3 5 16\ndirect\n0.666760 0.666760 0.109669 Li\n0.996172 0.996172 0.005255 Li\n0.000422 0.000422 0.501570 Li\n0.333140 0.333140 0.606576 Li\n0.337378 0.831736 0.786377 Ti\n0.831736 0.337378 0.786377 Ti\n0.170559 0.170559 0.283129 Ti\n0.667360 0.667360 0.514049 Cr\n0.829504 0.829504 0.786319 Cr\n0.336177 0.336177 0.016262 Cr\n0.169699 0.661337 0.289747 Cr\n0.661337 0.169699 0.289747 Cr\n0.330003 0.837490 0.397343 O\n0.520808 0.520808 0.661138 O\n0.661553 0.661553 0.896898 O\n0.001739 0.001739 0.688087 O\n0.001114 0.001114 0.191053 O\n0.837490 0.330003 0.397343 O\n0.516639 0.959205 0.659328 O\n0.959205 0.516639 0.659328 O\n0.165094 0.165094 0.895273 O\n0.834663 0.834663 0.395017 O\n0.040810 0.478082 0.159990 O\n0.478082 0.040810 0.159990 O\n0.329172 0.329172 0.397959 O\n0.171328 0.673192 0.897089 O\n0.478734 0.478734 0.164208 O\n0.673192 0.171328 0.897089 O\n",
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{
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"structure_string": "K2 Y1 In1 F6\n1.0\n0.000000 4.774722 4.774722\n4.774722 0.000000 4.774722\n4.774722 4.774722 0.000000\nK Y In F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Y\n0.500000 0.500000 0.500000 In\n0.771413 0.228587 0.228587 F\n0.228587 0.228587 0.771413 F\n0.228587 0.771413 0.771413 F\n0.228587 0.771413 0.228587 F\n0.771413 0.228587 0.771413 F\n0.771413 0.771413 0.228587 F\n",
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{
"id": "mp-1198662",
"created_at": "2022-09-04T14:40:19.898853Z",
"structure_string": "Pr10 In20 Ni10\n1.0\n2.210662 -9.284513 0.000000\n2.210662 9.284513 0.000000\n0.000000 0.000000 22.008931\nPr In Ni\n10 20 10\ndirect\n0.562528 0.437472 0.080151 Pr\n0.437472 0.562528 0.919849 Pr\n0.562528 0.437472 0.419849 Pr\n0.437472 0.562528 0.580151 Pr\n0.772045 0.227955 0.129026 Pr\n0.227955 0.772045 0.870974 Pr\n0.772045 0.227955 0.370974 Pr\n0.227955 0.772045 0.629026 Pr\n0.530419 0.469581 0.250000 Pr\n0.469581 0.530419 0.750000 Pr\n0.275095 0.724905 0.250000 In\n0.724905 0.275095 0.750000 In\n0.200329 0.799671 0.033163 In\n0.799671 0.200329 0.966837 In\n0.200329 0.799671 0.466837 In\n0.799671 0.200329 0.533163 In\n0.401133 0.598867 0.143396 In\n0.598867 0.401133 0.856604 In\n0.401133 0.598867 0.356604 In\n0.598867 0.401133 0.643396 In\n0.136548 0.863452 0.175248 In\n0.863452 0.136548 0.824752 In\n0.136548 0.863452 0.324752 In\n0.863452 0.136548 0.675248 In\n0.891768 0.108232 0.250000 In\n0.108232 0.891768 0.750000 In\n0.932658 0.067342 0.043229 In\n0.067342 0.932658 0.956771 In\n0.932658 0.067342 0.456771 In\n0.067342 0.932658 0.543229 In\n0.655390 0.344610 0.967791 Ni\n0.344610 0.655390 0.032209 Ni\n0.655390 0.344610 0.532209 Ni\n0.344610 0.655390 0.467791 Ni\n0.985243 0.014757 0.157755 Ni\n0.014757 0.985243 0.842245 Ni\n0.985243 0.014757 0.342245 Ni\n0.014757 0.985243 0.657755 Ni\n0.682559 0.317441 0.250000 Ni\n0.317441 0.682559 0.750000 Ni\n",
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{
"id": "mp-1246831",
"created_at": "2022-09-04T14:40:19.893228Z",
"structure_string": "Mn40 Co4 N36\n1.0\n6.299302 0.000000 0.568676\n0.000000 7.835388 0.000000\n-3.029423 0.000000 15.939635\nMn Co N\n40 4 36\ndirect\n0.437564 0.855112 0.092825 Mn\n0.562436 0.355112 0.407175 Mn\n0.562436 0.144888 0.907175 Mn\n0.437564 0.644888 0.592825 Mn\n0.530273 0.107533 0.569921 Mn\n0.469727 0.607533 0.930079 Mn\n0.469727 0.892467 0.430079 Mn\n0.530273 0.392467 0.069921 Mn\n0.797962 0.788742 0.730699 Mn\n0.202038 0.288742 0.769301 Mn\n0.202038 0.211258 0.269301 Mn\n0.797962 0.711258 0.230699 Mn\n0.746503 0.324440 0.717225 Mn\n0.253497 0.824440 0.782775 Mn\n0.253497 0.675560 0.282775 Mn\n0.746503 0.175560 0.217225 Mn\n0.731629 0.414189 0.867606 Mn\n0.268371 0.914189 0.632394 Mn\n0.268371 0.585811 0.132394 Mn\n0.731629 0.085811 0.367606 Mn\n0.958504 0.112709 0.870293 Mn\n0.041495 0.612709 0.629707 Mn\n0.041495 0.887291 0.129707 Mn\n0.958504 0.387291 0.370293 Mn\n0.968935 0.117229 0.637120 Mn\n0.031065 0.617229 0.862880 Mn\n0.031065 0.882771 0.362880 Mn\n0.968935 0.382771 0.137120 Mn\n0.250835 0.368277 0.597459 Mn\n0.749165 0.868277 0.902541 Mn\n0.749165 0.631723 0.402541 Mn\n0.250835 0.131723 0.097459 Mn\n0.520471 0.055028 0.757266 Mn\n0.479529 0.555028 0.742734 Mn\n0.479529 0.944972 0.242734 Mn\n0.520471 0.444972 0.257266 Mn\n0.766032 0.802769 0.542618 Mn\n0.233968 0.302769 0.957382 Mn\n0.233968 0.197231 0.457382 Mn\n0.766032 0.697231 0.042618 Mn\n0.745293 0.426138 0.568358 Co\n0.254707 0.926138 0.931642 Co\n0.254707 0.573862 0.431642 Co\n0.745293 0.073862 0.068358 Co\n0.524217 0.430592 0.638293 N\n0.475783 0.930592 0.861707 N\n0.475783 0.569408 0.361707 N\n0.524217 0.069408 0.138293 N\n0.518361 0.282573 0.797970 N\n0.481639 0.782573 0.702030 N\n0.481639 0.717427 0.202030 N\n0.518361 0.217427 0.297970 N\n0.811378 0.071687 0.962007 N\n0.188622 0.571687 0.537993 N\n0.188622 0.928313 0.037993 N\n0.811378 0.428313 0.462007 N\n0.478377 0.865928 0.548080 N\n0.521623 0.365928 0.951920 N\n0.521623 0.134072 0.451920 N\n0.478377 0.634072 0.048080 N\n0.694759 0.100661 0.673128 N\n0.305241 0.600661 0.826872 N\n0.305241 0.899339 0.326872 N\n0.694759 0.399339 0.173128 N\n0.996741 0.374011 0.655603 N\n0.003259 0.874011 0.844397 N\n0.003259 0.625989 0.344397 N\n0.996741 0.125989 0.155603 N\n0.035181 0.346636 0.867342 N\n0.964819 0.846636 0.632658 N\n0.964819 0.653364 0.132658 N\n0.035181 0.153364 0.367342 N\n0.221600 0.134872 0.568754 N\n0.778400 0.634872 0.931246 N\n0.778400 0.865128 0.431246 N\n0.221600 0.365128 0.068754 N\n0.219362 0.055508 0.728538 N\n0.780638 0.555508 0.771462 N\n0.780638 0.944492 0.271462 N\n0.219362 0.444492 0.228538 N\n",
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"formula_full": "Mn40 Co4 N36",
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{
"id": "mp-772075",
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"structure_string": "Li12 V6 P16 O58\n1.0\n-9.810100 0.000000 0.000000\n4.900342 8.509622 0.000000\n-0.013286 -0.027991 -13.926594\nLi V P O\n12 6 16 58\ndirect\n0.233517 0.910088 0.060249 Li\n0.680412 0.906186 0.561679 Li\n0.332896 0.663860 0.884425 Li\n0.673824 0.771413 0.060290 Li\n0.093223 0.328163 0.061273 Li\n0.776878 0.689783 0.441692 Li\n0.227760 0.317298 0.562775 Li\n0.901260 0.666921 0.937776 Li\n0.664832 0.334900 0.614212 Li\n0.303185 0.079206 0.440042 Li\n0.911580 0.224009 0.439517 Li\n0.014020 0.041462 0.992365 Li\n0.565965 0.566536 0.248600 V\n0.435559 0.430629 0.754108 V\n0.002146 0.567857 0.745240 V\n0.000363 0.433410 0.250358 V\n0.432846 0.999025 0.248488 V\n0.567007 0.004153 0.754718 V\n0.223987 0.910483 0.842912 P\n0.085710 0.769190 0.340441 P\n0.678764 0.912657 0.343502 P\n0.333105 0.666599 0.125205 P\n0.338570 0.666437 0.628508 P\n0.683054 0.773663 0.842177 P\n0.768944 0.677311 0.656623 P\n0.089950 0.316780 0.844697 P\n0.913181 0.683196 0.155744 P\n0.234514 0.320929 0.343828 P\n0.309325 0.224700 0.158290 P\n0.665514 0.332404 0.371487 P\n0.671439 0.337731 0.873265 P\n0.319276 0.088929 0.656412 P\n0.908700 0.229269 0.658936 P\n0.775436 0.085070 0.158549 P\n0.244666 0.001099 0.566782 O\n0.252839 0.914212 0.340741 O\n0.994466 0.768767 0.064692 O\n0.077145 0.744543 0.838625 O\n0.372766 0.892363 0.831545 O\n0.319749 0.809879 0.163682 O\n0.518421 0.900271 0.321711 O\n0.793665 0.996024 0.076634 O\n0.663157 0.917921 0.840291 O\n0.185338 0.655201 0.674786 O\n0.095311 0.617584 0.321367 O\n0.481983 0.819983 0.671475 O\n0.333985 0.667175 0.016716 O\n0.338807 0.663105 0.521874 O\n0.489749 0.679941 0.163842 O\n0.100471 0.479066 0.834374 O\n0.189363 0.510743 0.163293 O\n0.662792 0.748086 0.342001 O\n0.784638 0.784435 0.748847 O\n0.752027 0.756650 0.568956 O\n0.771218 0.769631 0.930289 O\n0.518028 0.624674 0.832396 O\n0.344074 0.520873 0.671482 O\n0.744905 0.662451 0.161272 O\n0.381632 0.481592 0.321305 O\n0.085290 0.336065 0.342369 O\n0.007337 0.795507 0.244447 O\n0.989844 0.758089 0.425698 O\n0.004405 0.247794 0.570051 O\n0.915494 0.660520 0.657558 O\n0.624155 0.511242 0.671060 O\n0.255702 0.340140 0.837479 O\n0.671052 0.485278 0.332178 O\n0.464460 0.379685 0.166949 O\n0.200958 0.207441 0.077404 O\n0.250723 0.249885 0.435574 O\n0.213753 0.203790 0.257854 O\n0.332037 0.252696 0.659695 O\n0.820895 0.484983 0.830006 O\n0.905623 0.525800 0.170448 O\n0.525627 0.340761 0.827431 O\n0.673569 0.345452 0.979603 O\n0.664043 0.332729 0.479767 O\n0.512813 0.185044 0.332157 O\n0.881382 0.370772 0.673326 O\n0.814106 0.326211 0.334594 O\n0.338495 0.082501 0.160298 O\n0.213858 0.999801 0.749469 O\n0.220268 0.992456 0.932994 O\n0.487277 0.113777 0.674160 O\n0.664089 0.185799 0.829028 O\n0.620153 0.085052 0.167256 O\n0.917660 0.256330 0.162072 O\n0.008728 0.227587 0.933856 O\n0.996435 0.213355 0.751374 O\n0.746921 0.078240 0.657067 O\n0.750725 0.000217 0.435582 O\n0.795900 0.009118 0.257726 O\n",
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