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{
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{
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"structure_string": "Li4 Ti3 Mn3 V2 O16\n1.0\n2.989779 5.124780 0.000000\n-2.989779 5.124780 0.000000\n0.000000 0.215743 9.639576\nLi Ti Mn V O\n4 3 3 2 16\ndirect\n0.331319 0.331319 0.894883 Li\n0.002090 0.002090 0.992373 Li\n0.002594 0.002594 0.496086 Li\n0.668251 0.668251 0.396439 Li\n0.165918 0.664295 0.215496 Ti\n0.664295 0.165918 0.215496 Ti\n0.827701 0.827701 0.718128 Ti\n0.169486 0.169486 0.211104 Mn\n0.340479 0.819415 0.713111 Mn\n0.819415 0.340479 0.713111 Mn\n0.329661 0.329661 0.490685 V\n0.658786 0.658786 0.984636 V\n0.160790 0.670945 0.597355 O\n0.481260 0.481260 0.337035 O\n0.333589 0.333589 0.107890 O\n0.004035 0.004035 0.309164 O\n0.001770 0.001770 0.803277 O\n0.670945 0.160790 0.597355 O\n0.043602 0.494239 0.344790 O\n0.494239 0.043602 0.344790 O\n0.838342 0.838342 0.109579 O\n0.178063 0.178063 0.582650 O\n0.525394 0.956699 0.838398 O\n0.956699 0.525394 0.838398 O\n0.666265 0.666265 0.608422 O\n0.329180 0.822713 0.098158 O\n0.512205 0.512205 0.850905 O\n0.822713 0.329180 0.098158 O\n",
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"formula_full": "Li4 Ti3 Mn3 V2 O16",
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{
"id": "mp-1304218",
"created_at": "2022-09-04T14:43:04.709111Z",
"structure_string": "Li6 Mg2 Ni6 O16\n1.0\n-4.256436 -2.430258 0.050511\n4.274966 -4.177160 4.804072\n-1.555005 5.810468 4.887539\nLi Mg Ni O\n6 2 6 16\ndirect\n0.995444 0.883569 0.619189 Li\n0.995434 0.383555 0.119192 Li\n0.502037 0.505797 0.998784 Li\n0.502015 0.005803 0.498780 Li\n0.502394 0.737554 0.768602 Li\n0.502302 0.237548 0.268576 Li\n0.498850 0.126107 0.874983 Mg\n0.498817 0.626103 0.374988 Mg\n0.998284 0.753673 0.248743 Ni\n0.998298 0.253696 0.748754 Ni\n0.499710 0.877024 0.129309 Ni\n0.499756 0.377025 0.629314 Ni\n0.997770 0.002184 0.003106 Ni\n0.997781 0.502199 0.503102 Ni\n0.207929 0.244030 0.979299 O\n0.207793 0.744006 0.479257 O\n0.773531 0.520453 0.247312 O\n0.773624 0.020419 0.747353 O\n0.257974 0.154065 0.642488 O\n0.257856 0.654048 0.142449 O\n0.741655 0.863995 0.347801 O\n0.741655 0.364005 0.847815 O\n0.759245 0.771804 0.026859 O\n0.759223 0.271815 0.526850 O\n0.253710 0.478027 0.742845 O\n0.253671 0.977977 0.242706 O\n0.262796 0.389666 0.407671 O\n0.262821 0.889674 0.907677 O\n0.734303 0.102458 0.111616 O\n0.734242 0.602574 0.611616 O\n",
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"formula_full": "Li6 Mg2 Ni6 O16",
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{
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"created_at": "2022-09-04T14:43:04.850147Z",
"structure_string": "Ti1 N1\n1.0\n0.000000 2.301213 2.301213\n2.301213 0.000000 2.301213\n2.301213 2.301213 0.000000\nTi N\n1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.250000 0.250000 0.250000 N\n",
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{
"id": "mp-1044907",
"created_at": "2022-09-04T14:43:04.862213Z",
"structure_string": "Mg6 Ti12 O24\n1.0\n2.989739 -5.178381 0.000000\n2.989739 5.178381 0.000000\n0.000000 0.000000 15.032516\nMg Ti O\n6 12 24\ndirect\n0.666667 0.333333 0.955345 Mg\n0.333333 0.666667 0.623926 Mg\n0.000000 0.000000 0.661462 Mg\n0.000000 0.000000 0.301465 Mg\n0.333333 0.666667 0.999013 Mg\n0.333333 0.666667 0.371261 Mg\n0.161132 0.322265 0.834673 Ti\n0.677735 0.838868 0.834673 Ti\n0.827685 0.655371 0.499377 Ti\n0.161132 0.838868 0.834673 Ti\n0.344629 0.172315 0.499377 Ti\n0.666667 0.333333 0.322094 Ti\n0.666667 0.333333 0.711783 Ti\n0.512104 0.024209 0.171622 Ti\n0.827685 0.172315 0.499377 Ti\n0.975791 0.487896 0.171622 Ti\n0.512104 0.487896 0.171622 Ti\n0.000000 0.000000 0.050095 Ti\n0.488629 0.977258 0.908993 O\n0.333333 0.666667 0.758386 O\n0.022742 0.511371 0.908993 O\n0.488629 0.511371 0.908993 O\n0.155320 0.310641 0.574928 O\n0.840449 0.159551 0.750282 O\n0.000000 0.000000 0.429965 O\n0.319103 0.159551 0.750282 O\n0.000000 0.000000 0.924156 O\n0.689359 0.844680 0.574928 O\n0.155320 0.844680 0.574928 O\n0.840449 0.680897 0.750282 O\n0.830838 0.661676 0.249578 O\n0.513106 0.486894 0.417309 O\n0.973789 0.486894 0.417309 O\n0.666667 0.333333 0.086137 O\n0.666667 0.333333 0.585157 O\n0.338324 0.169162 0.249578 O\n0.830838 0.169162 0.249578 O\n0.513106 0.026211 0.417309 O\n0.173894 0.826106 0.087042 O\n0.652213 0.826106 0.087042 O\n0.333333 0.666667 0.238140 O\n0.173894 0.347787 0.087042 O\n",
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},
{
"id": "mp-1039167",
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{
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"structure_string": "Li6 Fe12 P12 O48\n1.0\n8.179025 0.000000 0.000000\n-0.070308 8.882882 0.000000\n-0.096679 -0.074009 15.249962\nLi Fe P O\n6 12 12 48\ndirect\n0.055413 0.227180 0.904744 Li\n0.303906 0.256955 0.250705 Li\n0.566779 0.249248 0.589776 Li\n0.689142 0.745665 0.751189 Li\n0.945959 0.774632 0.097481 Li\n0.055488 0.767237 0.441080 Li\n0.267801 0.044777 0.093743 Fe\n0.205215 0.078307 0.726539 Fe\n0.263665 0.106206 0.432612 Fe\n0.780632 0.382569 0.072658 Fe\n0.726997 0.403468 0.769885 Fe\n0.783722 0.449857 0.403593 Fe\n0.220484 0.548187 0.601126 Fe\n0.284986 0.598769 0.229870 Fe\n0.220525 0.616038 0.923941 Fe\n0.733437 0.887644 0.570684 Fe\n0.785250 0.921704 0.272836 Fe\n0.728169 0.956872 0.907795 Fe\n0.671557 0.045800 0.095970 P\n0.826326 0.086574 0.727575 P\n0.664745 0.118667 0.427031 P\n0.161636 0.394668 0.076095 P\n0.334156 0.405049 0.774037 P\n0.164586 0.440839 0.408948 P\n0.839075 0.559291 0.591856 P\n0.675324 0.590215 0.224941 P\n0.840669 0.607459 0.923028 P\n0.332547 0.878558 0.574960 P\n0.162041 0.916247 0.272377 P\n0.326381 0.953903 0.902439 P\n0.344992 0.026025 0.633138 O\n0.496177 0.017728 0.886107 O\n0.220734 0.054256 0.963016 O\n0.248201 0.066415 0.297498 O\n0.774636 0.076461 0.504605 O\n0.765258 0.066863 0.185283 O\n0.857366 0.101776 0.828339 O\n0.993808 0.090865 0.679277 O\n0.497739 0.172193 0.462936 O\n0.659707 0.206155 0.053914 O\n0.718774 0.217568 0.693605 O\n0.744907 0.248727 0.373002 O\n0.252931 0.271957 0.127887 O\n0.223632 0.263588 0.792954 O\n0.123813 0.285997 0.446125 O\n0.997497 0.323826 0.038799 O\n0.499694 0.393608 0.817697 O\n0.351946 0.415653 0.670983 O\n0.262444 0.430398 0.323325 O\n0.260473 0.441837 0.992955 O\n0.771157 0.452689 0.189311 O\n0.736139 0.456867 0.527285 O\n0.002683 0.480362 0.614826 O\n0.879677 0.469949 0.864800 O\n0.126242 0.533205 0.133439 O\n0.001039 0.529813 0.391546 O\n0.259506 0.539712 0.478354 O\n0.240600 0.546501 0.806302 O\n0.740704 0.558115 0.004870 O\n0.739188 0.578754 0.676676 O\n0.663873 0.574546 0.326717 O\n0.508914 0.599846 0.181628 O\n0.005014 0.677664 0.959730 O\n0.879094 0.710480 0.545735 O\n0.780090 0.736049 0.206388 O\n0.748133 0.729754 0.872013 O\n0.249862 0.752588 0.631355 O\n0.262514 0.781711 0.302212 O\n0.340520 0.792631 0.943579 O\n0.502190 0.830541 0.547511 O\n0.996639 0.906212 0.326304 O\n0.121284 0.913320 0.172196 O\n0.229738 0.933199 0.813945 O\n0.217336 0.911378 0.496151 O\n0.741615 0.934896 0.704608 O\n0.779624 0.944364 0.037001 O\n0.500643 0.982225 0.110535 O\n0.642931 0.983018 0.362280 O\n",
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{
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