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{
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{
"id": "mp-1195016",
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"structure_string": "Ba4 Te16 O36\n1.0\n2.300110 9.990152 0.000000\n-2.300110 9.990152 0.000000\n0.000000 9.165278 21.691781\nBa Te O\n4 16 36\ndirect\n0.501404 0.081307 0.659072 Ba\n0.918693 0.498596 0.840928 Ba\n0.498596 0.918693 0.340928 Ba\n0.081307 0.501404 0.159072 Ba\n0.713338 0.681583 0.550364 Te\n0.318417 0.286662 0.949636 Te\n0.286662 0.318417 0.449636 Te\n0.681583 0.713338 0.050364 Te\n0.780019 0.444552 0.719184 Te\n0.555448 0.219981 0.780816 Te\n0.219981 0.555448 0.280816 Te\n0.444552 0.780019 0.219184 Te\n0.212734 0.866225 0.847333 Te\n0.133775 0.787266 0.652667 Te\n0.787266 0.133775 0.152667 Te\n0.866225 0.212734 0.347333 Te\n0.767116 0.065359 0.008587 Te\n0.934641 0.232884 0.491413 Te\n0.232884 0.934641 0.991413 Te\n0.065359 0.767116 0.508587 Te\n0.086810 0.434292 0.552327 O\n0.565708 0.913190 0.947673 O\n0.913190 0.565708 0.447673 O\n0.434292 0.086810 0.052327 O\n0.644421 0.131041 0.934529 O\n0.868959 0.355579 0.565471 O\n0.355579 0.868959 0.065471 O\n0.131041 0.644421 0.434529 O\n0.592311 0.740302 0.639268 O\n0.259698 0.407689 0.860732 O\n0.407689 0.259698 0.360732 O\n0.740302 0.592311 0.139268 O\n0.834131 0.280978 0.818086 O\n0.719022 0.165869 0.681914 O\n0.165869 0.719022 0.181914 O\n0.280978 0.834131 0.318086 O\n0.927844 0.476486 0.724618 O\n0.523514 0.072156 0.775382 O\n0.072156 0.523514 0.275382 O\n0.476486 0.927844 0.224618 O\n0.354846 0.897460 0.858480 O\n0.102540 0.645154 0.641520 O\n0.645154 0.102540 0.141520 O\n0.897460 0.354846 0.358480 O\n0.004259 0.007731 0.943431 O\n0.992269 0.995741 0.556569 O\n0.995741 0.992269 0.056569 O\n0.007731 0.004259 0.443431 O\n0.366518 0.809910 0.753697 O\n0.190090 0.633482 0.746303 O\n0.633482 0.190090 0.246303 O\n0.809910 0.366518 0.253697 O\n0.055956 0.670700 0.031508 O\n0.329300 0.944044 0.468492 O\n0.944044 0.329300 0.968492 O\n0.670700 0.055956 0.531508 O\n",
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"formula_full": "Ba4 Te16 O36",
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{
"id": "mp-1195118",
"created_at": "2022-09-04T14:44:29.235812Z",
"structure_string": "Ba4 Te12 O28\n1.0\n5.363520 0.000000 0.000000\n0.000000 10.469830 0.000000\n0.000000 8.133805 13.651381\nBa Te O\n4 12 28\ndirect\n0.739944 0.419062 0.395968 Ba\n0.760056 0.419062 0.895968 Ba\n0.260056 0.580938 0.604032 Ba\n0.239944 0.580938 0.104032 Ba\n0.224961 0.735768 0.292122 Te\n0.275039 0.735768 0.792122 Te\n0.775039 0.264232 0.707878 Te\n0.724961 0.264232 0.207878 Te\n0.737253 0.811447 0.393584 Te\n0.762747 0.811447 0.893584 Te\n0.262747 0.188553 0.606416 Te\n0.237253 0.188553 0.106416 Te\n0.308524 0.075631 0.407293 Te\n0.191476 0.075631 0.907293 Te\n0.691476 0.924369 0.592707 Te\n0.808524 0.924369 0.092707 Te\n0.280855 0.564083 0.287912 O\n0.219145 0.564083 0.787912 O\n0.719145 0.435917 0.712088 O\n0.780855 0.435917 0.212088 O\n0.026225 0.658944 0.411152 O\n0.473775 0.658944 0.911152 O\n0.973775 0.341056 0.588848 O\n0.526225 0.341056 0.088848 O\n0.869606 0.760540 0.230984 O\n0.630394 0.760540 0.730984 O\n0.130394 0.239460 0.769016 O\n0.369606 0.239460 0.269016 O\n0.521198 0.657934 0.404258 O\n0.978802 0.657934 0.904258 O\n0.478802 0.342066 0.595742 O\n0.021198 0.342066 0.095742 O\n0.772960 0.744227 0.527141 O\n0.727040 0.744227 0.027141 O\n0.227040 0.255773 0.472859 O\n0.272960 0.255773 0.972859 O\n0.380727 0.918232 0.380172 O\n0.119273 0.918232 0.880172 O\n0.619273 0.081768 0.619828 O\n0.880727 0.081768 0.119828 O\n0.648264 0.103872 0.433502 O\n0.851736 0.103872 0.933502 O\n0.351736 0.896128 0.566498 O\n0.148264 0.896128 0.066498 O\n",
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{
"id": "mp-754967",
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"structure_string": "Ba4 Te4 O16\n1.0\n5.148304 0.000000 0.000000\n0.000000 6.010591 0.000000\n0.000000 0.000000 13.837266\nBa Te O\n4 4 16\ndirect\n0.250000 0.000000 0.164613 Ba\n0.750000 0.000000 0.835387 Ba\n0.250000 0.500000 0.664613 Ba\n0.750000 0.500000 0.335387 Ba\n0.250000 0.000000 0.433218 Te\n0.750000 0.000000 0.566782 Te\n0.750000 0.500000 0.066782 Te\n0.250000 0.500000 0.933218 Te\n0.352073 0.209124 0.339762 O\n0.852073 0.209124 0.660238 O\n0.928068 0.176154 0.459594 O\n0.428068 0.176154 0.540406 O\n0.428068 0.323846 0.040406 O\n0.928068 0.323846 0.959594 O\n0.852073 0.290876 0.160238 O\n0.352073 0.290876 0.839762 O\n0.647927 0.709124 0.160238 O\n0.147927 0.709124 0.839762 O\n0.071932 0.676154 0.040406 O\n0.571932 0.676154 0.959594 O\n0.571932 0.823846 0.459594 O\n0.071932 0.823846 0.540406 O\n0.147927 0.790876 0.339762 O\n0.647927 0.790876 0.660238 O\n",
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{
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{
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