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{
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{
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"structure_string": "Li8 Mn12 F32\n1.0\n9.552700 0.000000 0.000000\n0.000000 6.864314 0.000000\n0.000000 0.382959 11.382092\nLi Mn F\n8 12 32\ndirect\n0.055279 0.901426 0.856942 Li\n0.444721 0.901426 0.356942 Li\n0.606728 0.588488 0.859762 Li\n0.893272 0.588488 0.359762 Li\n0.106728 0.411512 0.640238 Li\n0.393272 0.411512 0.140238 Li\n0.555279 0.098574 0.643058 Li\n0.944721 0.098574 0.143058 Li\n0.196642 0.907403 0.566350 Mn\n0.303358 0.907403 0.066350 Mn\n0.843703 0.760398 0.643756 Mn\n0.656297 0.760398 0.143756 Mn\n0.454026 0.610264 0.623460 Mn\n0.045974 0.610264 0.123460 Mn\n0.954026 0.389736 0.876540 Mn\n0.545974 0.389736 0.376540 Mn\n0.343703 0.239602 0.856244 Mn\n0.156297 0.239602 0.356244 Mn\n0.696642 0.092597 0.933650 Mn\n0.803358 0.092597 0.433650 Mn\n0.247437 0.960914 0.890986 F\n0.252563 0.960914 0.390986 F\n0.402448 0.918872 0.625565 F\n0.097552 0.918872 0.125565 F\n0.039549 0.872231 0.690906 F\n0.460451 0.872231 0.190906 F\n0.616299 0.799092 0.963364 F\n0.883701 0.799092 0.463364 F\n0.991897 0.672132 0.938808 F\n0.650507 0.676154 0.704139 F\n0.508103 0.672132 0.438808 F\n0.849493 0.676154 0.204139 F\n0.233122 0.604377 0.582609 F\n0.266878 0.604377 0.082609 F\n0.425429 0.511033 0.806533 F\n0.074571 0.511033 0.306533 F\n0.925429 0.488967 0.693467 F\n0.574571 0.488967 0.193467 F\n0.733122 0.395623 0.917391 F\n0.766878 0.395623 0.417391 F\n0.150507 0.323846 0.795861 F\n0.491897 0.327868 0.561192 F\n0.349493 0.323846 0.295861 F\n0.008103 0.327868 0.061192 F\n0.116299 0.200908 0.536636 F\n0.383701 0.200908 0.036636 F\n0.539549 0.127769 0.809094 F\n0.960451 0.127769 0.309094 F\n0.902448 0.081128 0.874435 F\n0.597552 0.081128 0.374435 F\n0.747437 0.039086 0.609014 F\n0.752563 0.039086 0.109014 F\n",
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{
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"structure_string": "In4 H16 S8 N4 O32\n1.0\n10.649151 0.000000 0.000000\n0.000000 9.256641 0.000000\n0.000000 1.235489 10.125911\nIn H S N O\n4 16 8 4 32\ndirect\n0.245210 0.626966 0.224286 In\n0.745210 0.373034 0.775714 In\n0.996259 0.877148 0.870761 In\n0.496259 0.122852 0.129239 In\n0.183069 0.253509 0.400388 H\n0.683069 0.746491 0.599612 H\n0.183716 0.589618 0.573711 H\n0.683716 0.410382 0.426289 H\n0.178160 0.913821 0.699856 H\n0.678160 0.086179 0.300144 H\n0.409081 0.274661 0.120138 H\n0.909081 0.725339 0.879862 H\n0.204844 0.981878 0.362661 H\n0.704844 0.018122 0.637339 H\n0.657950 0.694636 0.019290 H\n0.157950 0.305364 0.980710 H\n0.857883 0.665416 0.442784 H\n0.357883 0.334584 0.557216 H\n0.148016 0.530151 0.332932 H\n0.648016 0.469849 0.667068 H\n0.231014 0.982462 0.045147 S\n0.731014 0.017538 0.954853 S\n0.666430 0.459327 0.038965 S\n0.166430 0.540673 0.961035 S\n0.386834 0.884031 0.411013 S\n0.886834 0.115969 0.588987 S\n0.487526 0.392035 0.401548 S\n0.987526 0.607965 0.598452 S\n0.459592 0.749588 0.833322 N\n0.959592 0.250412 0.166678 N\n0.903277 0.758480 0.192077 N\n0.403277 0.241520 0.807923 N\n0.060566 0.552070 0.049571 O\n0.560566 0.447930 0.950429 O\n0.343144 0.736230 0.386899 O\n0.843144 0.263770 0.613101 O\n0.156577 0.992152 0.916559 O\n0.656577 0.007848 0.083441 O\n0.366575 0.985228 0.009324 O\n0.866575 0.014772 0.990676 O\n0.168845 0.642320 0.841079 O\n0.668845 0.357680 0.158921 O\n0.664530 0.614437 0.092478 O\n0.164530 0.385563 0.907522 O\n0.423846 0.472604 0.291430 O\n0.923846 0.527396 0.708570 O\n0.415756 0.416705 0.534203 O\n0.915756 0.583295 0.465797 O\n0.011047 0.760146 0.599845 O\n0.511047 0.239854 0.400155 O\n0.195983 0.102299 0.118474 O\n0.695983 0.897701 0.881526 O\n0.444130 0.954625 0.287620 O\n0.944130 0.045375 0.712380 O\n0.262518 0.973618 0.438439 O\n0.762518 0.026382 0.561561 O\n0.196954 0.838349 0.123091 O\n0.696954 0.161651 0.876909 O\n0.111848 0.522632 0.575491 O\n0.611848 0.477368 0.424509 O\n0.287881 0.544408 0.039331 O\n0.787881 0.455592 0.960669 O\n0.460271 0.886420 0.527994 O\n0.960271 0.113580 0.472006 O\n",
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},
{
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"created_at": "2022-09-04T14:48:09.900533Z",
"structure_string": "Na8 Ga6 Si6 B2 H8 O24\n1.0\n9.040778 0.000000 0.000000\n0.000000 9.040778 0.000000\n0.000000 0.000000 9.040778\nNa Ga Si B H O\n8 6 6 2 8 24\ndirect\n0.827881 0.827881 0.172119 Na\n0.827881 0.172119 0.827881 Na\n0.172119 0.827881 0.827881 Na\n0.172119 0.172119 0.172119 Na\n0.327881 0.327881 0.672119 Na\n0.327881 0.672119 0.327881 Na\n0.672119 0.327881 0.327881 Na\n0.672119 0.672119 0.672119 Na\n0.750000 0.000000 0.500000 Ga\n0.000000 0.500000 0.750000 Ga\n0.250000 0.000000 0.500000 Ga\n0.500000 0.250000 0.000000 Ga\n0.500000 0.750000 0.000000 Ga\n0.000000 0.500000 0.250000 Ga\n0.750000 0.500000 0.000000 Si\n0.000000 0.750000 0.500000 Si\n0.250000 0.500000 0.000000 Si\n0.500000 0.000000 0.250000 Si\n0.500000 0.000000 0.750000 Si\n0.000000 0.250000 0.500000 Si\n0.000000 0.000000 0.000000 B\n0.500000 0.500000 0.500000 B\n0.578513 0.578513 0.421487 H\n0.578513 0.421487 0.578513 H\n0.078513 0.078513 0.921487 H\n0.078513 0.921487 0.078513 H\n0.421487 0.578513 0.578513 H\n0.421487 0.421487 0.421487 H\n0.921487 0.921487 0.921487 H\n0.921487 0.078513 0.078513 H\n0.573603 0.866018 0.151203 O\n0.573603 0.133982 0.848797 O\n0.848797 0.573603 0.133982 O\n0.848797 0.426397 0.866018 O\n0.866018 0.151203 0.573603 O\n0.866018 0.848797 0.426397 O\n0.073603 0.348797 0.633982 O\n0.073603 0.651203 0.366018 O\n0.133982 0.848797 0.573603 O\n0.133982 0.151203 0.426397 O\n0.151203 0.573603 0.866018 O\n0.151203 0.426397 0.133982 O\n0.348797 0.366018 0.926397 O\n0.348797 0.633982 0.073603 O\n0.366018 0.073603 0.651203 O\n0.366018 0.926397 0.348797 O\n0.426397 0.866018 0.848797 O\n0.426397 0.133982 0.151203 O\n0.633982 0.073603 0.348797 O\n0.633982 0.926397 0.651203 O\n0.651203 0.366018 0.073603 O\n0.651203 0.633982 0.926397 O\n0.926397 0.348797 0.366018 O\n0.926397 0.651203 0.633982 O\n",
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{
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{
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"is_theoretical": true,
"updated_at": "2021-11-28T01:34:32.981000Z",
"spacegroup": 96
}
]
}