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{
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{
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{
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"structure_string": "Sc2 O3\n1.0\n1.694840 -2.935549 0.000000\n1.694840 2.935549 0.000000\n0.000000 0.000000 5.666015\nSc O\n2 3\ndirect\n0.666667 0.333333 0.751167 Sc\n0.333333 0.666667 0.248833 Sc\n0.666667 0.333333 0.352039 O\n0.333333 0.666667 0.647961 O\n0.000000 0.000000 0.000000 O\n",
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{
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{
"id": "mp-1094582",
"created_at": "2022-09-04T14:39:43.835162Z",
"structure_string": "Li2 Mg4\n1.0\n1.596460 -2.765149 0.000000\n1.596460 2.765149 0.000000\n0.000000 0.000000 14.828794\nLi Mg\n2 4\ndirect\n0.666667 0.333333 0.750000 Li\n0.333333 0.666667 0.250000 Li\n0.333333 0.666667 0.914745 Mg\n0.333333 0.666667 0.585255 Mg\n0.666667 0.333333 0.414745 Mg\n0.666667 0.333333 0.085255 Mg\n",
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{
"id": "mp-1039698",
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"structure_string": "Na1 Mg30 Bi1 O32\n1.0\n8.609577 0.000000 0.000000\n0.000000 8.609577 0.000000\n0.000000 0.000000 8.652139\nNa Mg Bi O\n1 30 1 32\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.255383 0.240507 Mg\n0.000000 0.255383 0.759493 Mg\n0.000000 0.744617 0.240507 Mg\n0.000000 0.744617 0.759493 Mg\n0.500000 0.250192 0.248362 Mg\n0.500000 0.250192 0.751638 Mg\n0.500000 0.749808 0.248362 Mg\n0.500000 0.749808 0.751638 Mg\n0.255383 0.000000 0.240507 Mg\n0.255383 0.000000 0.759493 Mg\n0.250192 0.500000 0.248362 Mg\n0.250192 0.500000 0.751638 Mg\n0.744617 0.000000 0.240507 Mg\n0.744617 0.000000 0.759493 Mg\n0.749808 0.500000 0.248362 Mg\n0.749808 0.500000 0.751638 Mg\n0.249358 0.249358 0.000000 Mg\n0.256681 0.256681 0.500000 Mg\n0.249358 0.750642 0.000000 Mg\n0.256681 0.743319 0.500000 Mg\n0.750642 0.249358 0.000000 Mg\n0.743319 0.256681 0.500000 Mg\n0.750642 0.750642 0.000000 Mg\n0.743319 0.743319 0.500000 Mg\n0.000000 0.000000 0.500000 Bi\n0.265079 0.000000 0.000000 O\n0.267601 0.000000 0.500000 O\n0.252637 0.500000 0.000000 O\n0.252832 0.500000 0.500000 O\n0.734921 0.000000 0.000000 O\n0.732399 0.000000 0.500000 O\n0.747363 0.500000 0.000000 O\n0.747168 0.500000 0.500000 O\n0.249194 0.249194 0.251311 O\n0.249194 0.249194 0.748689 O\n0.249194 0.750806 0.251311 O\n0.249194 0.750806 0.748689 O\n0.750806 0.249194 0.251311 O\n0.750806 0.249194 0.748689 O\n0.750806 0.750806 0.251311 O\n0.750806 0.750806 0.748689 O\n0.000000 0.000000 0.241556 O\n0.000000 0.000000 0.758444 O\n0.000000 0.500000 0.250477 O\n0.000000 0.500000 0.749523 O\n0.500000 0.000000 0.250477 O\n0.500000 0.000000 0.749523 O\n0.500000 0.500000 0.250679 O\n0.500000 0.500000 0.749321 O\n0.000000 0.265079 0.000000 O\n0.000000 0.267601 0.500000 O\n0.000000 0.734921 0.000000 O\n0.000000 0.732399 0.500000 O\n0.500000 0.252637 0.000000 O\n0.500000 0.252832 0.500000 O\n0.500000 0.747363 0.000000 O\n0.500000 0.747168 0.500000 O\n",
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{
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},
{
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{
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"structure_string": "Ca32 Ti12 Mn20 O80\n1.0\n11.194283 -0.078617 -0.184843\n-0.106328 15.446599 -0.001056\n-0.179291 0.008617 11.332815\nCa Ti Mn O\n32 12 20 80\ndirect\n0.975002 0.124021 0.538463 Ca\n0.974974 0.121934 0.034031 Ca\n0.978983 0.620517 0.539958 Ca\n0.978845 0.621716 0.016280 Ca\n0.545470 0.123427 0.479937 Ca\n0.541936 0.122443 0.982148 Ca\n0.545942 0.626040 0.477508 Ca\n0.552605 0.621318 0.977458 Ca\n0.527732 0.374189 0.986408 Ca\n0.511491 0.371107 0.486843 Ca\n0.527589 0.867101 0.978096 Ca\n0.518901 0.872560 0.477075 Ca\n0.954758 0.382793 0.015443 Ca\n0.954423 0.387468 0.516124 Ca\n0.954774 0.879802 0.011822 Ca\n0.954081 0.879243 0.512964 Ca\n0.242375 0.388787 0.265643 Ca\n0.244680 0.394401 0.714827 Ca\n0.244672 0.887099 0.268124 Ca\n0.241073 0.891406 0.746629 Ca\n0.739753 0.378327 0.259197 Ca\n0.749831 0.376738 0.767034 Ca\n0.734682 0.863077 0.246057 Ca\n0.730457 0.859079 0.747489 Ca\n0.227284 0.120492 0.221685 Ca\n0.228434 0.120032 0.732456 Ca\n0.232283 0.621986 0.217814 Ca\n0.219803 0.615355 0.736956 Ca\n0.758530 0.124210 0.255372 Ca\n0.753440 0.125437 0.753524 Ca\n0.774976 0.617591 0.254191 Ca\n0.768191 0.614532 0.752249 Ca\n0.988143 0.996500 0.273828 Ti\n0.981138 0.996234 0.769642 Ti\n0.001521 0.500580 0.271817 Ti\n0.245639 0.973523 0.018806 Ti\n0.235100 0.984837 0.514046 Ti\n0.246570 0.469506 0.014663 Ti\n0.264158 0.246112 0.941821 Ti\n0.262754 0.232903 0.446916 Ti\n0.265121 0.743260 0.943184 Ti\n0.994006 0.254383 0.283707 Ti\n0.994671 0.255573 0.784114 Ti\n0.005340 0.752370 0.279264 Ti\n0.993982 0.495513 0.761888 Mn\n0.500837 0.991548 0.225184 Mn\n0.496739 0.993171 0.726213 Mn\n0.500826 0.500256 0.233366 Mn\n0.494443 0.490511 0.725932 Mn\n0.228099 0.526306 0.505230 Mn\n0.742182 0.999765 0.993968 Mn\n0.743012 0.999758 0.496166 Mn\n0.750837 0.500635 0.003168 Mn\n0.740928 0.501059 0.502245 Mn\n0.274946 0.735071 0.446373 Mn\n0.744674 0.247977 0.009779 Mn\n0.744604 0.250785 0.507023 Mn\n0.753495 0.747895 0.999533 Mn\n0.752073 0.749447 0.500222 Mn\n0.993572 0.755736 0.773431 Mn\n0.499662 0.252808 0.251458 Mn\n0.500170 0.253691 0.752078 Mn\n0.507531 0.742479 0.245807 Mn\n0.493242 0.746438 0.746050 Mn\n0.567141 0.250530 0.090184 O\n0.569186 0.250868 0.591794 O\n0.599330 0.755760 0.092690 O\n0.555615 0.753609 0.582682 O\n0.385764 0.179400 0.367272 O\n0.384469 0.185713 0.872253 O\n0.397505 0.663201 0.341314 O\n0.391585 0.684880 0.882924 O\n0.921555 0.238466 0.419630 O\n0.919708 0.237394 0.919214 O\n0.934738 0.737434 0.417636 O\n0.908361 0.743974 0.927145 O\n0.172549 0.250294 0.306389 O\n0.175608 0.258367 0.801915 O\n0.175633 0.752904 0.286550 O\n0.184004 0.755851 0.803323 O\n0.654230 0.231953 0.345072 O\n0.654675 0.234681 0.845907 O\n0.664605 0.727244 0.347129 O\n0.650677 0.723830 0.838379 O\n0.876902 0.269361 0.165580 O\n0.880578 0.266995 0.662862 O\n0.887460 0.781543 0.167931 O\n0.859114 0.777376 0.644277 O\n0.357368 0.527256 0.109962 O\n0.347753 0.518253 0.643939 O\n0.355526 0.030155 0.115483 O\n0.350540 0.031412 0.617797 O\n0.871729 0.478004 0.163818 O\n0.840864 0.477927 0.647152 O\n0.866340 0.975164 0.169772 O\n0.858651 0.975558 0.667520 O\n0.198765 0.016931 0.361689 O\n0.224592 0.010098 0.868994 O\n0.171453 0.511887 0.337317 O\n0.211924 0.500721 0.865755 O\n0.627833 0.030433 0.341107 O\n0.624692 0.032962 0.841895 O\n0.645859 0.522203 0.348013 O\n0.625038 0.515639 0.838000 O\n0.904431 0.016019 0.410376 O\n0.899255 0.015651 0.908792 O\n0.913905 0.518020 0.401236 O\n0.894763 0.510335 0.902907 O\n0.113466 0.467870 0.102112 O\n0.094509 0.478223 0.620167 O\n0.112734 0.976017 0.108894 O\n0.106251 0.976534 0.612225 O\n0.604156 0.490929 0.091818 O\n0.578144 0.495708 0.584320 O\n0.598962 0.982450 0.081852 O\n0.596898 0.984674 0.583264 O\n0.019955 0.375649 0.306071 O\n0.010545 0.374910 0.808788 O\n0.031838 0.883508 0.316598 O\n0.034335 0.888716 0.815491 O\n0.448336 0.379125 0.290771 O\n0.441653 0.376405 0.794621 O\n0.453633 0.868322 0.280409 O\n0.444382 0.872835 0.787440 O\n0.010460 0.123411 0.238678 O\n0.014822 0.122056 0.745771 O\n0.004814 0.626930 0.227159 O\n0.999736 0.620944 0.745002 O\n0.178391 0.179357 0.035434 O\n0.178401 0.165533 0.544316 O\n0.178669 0.672400 0.028946 O\n0.183638 0.653680 0.545463 O\n0.755674 0.120341 0.047041 O\n0.755828 0.122091 0.544644 O\n0.762292 0.625287 0.044492 O\n0.756437 0.627125 0.542383 O\n0.297490 0.338043 0.510607 O\n0.299410 0.352292 0.021354 O\n0.285897 0.871925 0.496591 O\n0.295048 0.856318 0.014105 O\n0.745267 0.377886 0.464694 O\n0.746153 0.376138 0.975413 O\n0.747094 0.874184 0.455039 O\n0.745370 0.874539 0.957200 O\n",
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}
]
}