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{
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{
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{
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{
"id": "mp-1195033",
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"structure_string": "Ba12 Nb8 Se36\n1.0\n7.457707 0.000000 0.000000\n0.000000 12.578958 0.000000\n-2.300090 0.000000 17.704832\nBa Nb Se\n12 8 36\ndirect\n0.262395 0.911022 0.915285 Ba\n0.737605 0.411022 0.584715 Ba\n0.737605 0.088978 0.084715 Ba\n0.262395 0.588978 0.415285 Ba\n0.745173 0.743607 0.746199 Ba\n0.254827 0.243607 0.753801 Ba\n0.254827 0.256393 0.253801 Ba\n0.745173 0.756393 0.246199 Ba\n0.742867 0.431337 0.919809 Ba\n0.257133 0.931337 0.580191 Ba\n0.257133 0.568663 0.080191 Ba\n0.742867 0.068663 0.419809 Ba\n0.713726 0.055617 0.850893 Nb\n0.286274 0.555617 0.649107 Nb\n0.286274 0.944383 0.149107 Nb\n0.713726 0.444383 0.350893 Nb\n0.219770 0.567457 0.846524 Nb\n0.780230 0.067457 0.653476 Nb\n0.780230 0.432543 0.153476 Nb\n0.219770 0.932543 0.346524 Nb\n0.245377 0.726689 0.740871 Se\n0.754623 0.226689 0.759129 Se\n0.754623 0.273311 0.259129 Se\n0.245377 0.773311 0.240871 Se\n0.035783 0.704578 0.619383 Se\n0.964217 0.204578 0.880617 Se\n0.964217 0.295422 0.380617 Se\n0.035783 0.795422 0.119383 Se\n0.002786 0.658224 0.916091 Se\n0.997214 0.158224 0.583909 Se\n0.997214 0.341776 0.083909 Se\n0.002786 0.841776 0.416091 Se\n0.989133 0.983177 0.759645 Se\n0.010867 0.483177 0.740355 Se\n0.010867 0.016823 0.240355 Se\n0.989133 0.516823 0.259645 Se\n0.816111 0.917165 0.940238 Se\n0.183889 0.417165 0.559762 Se\n0.183889 0.082835 0.059762 Se\n0.816111 0.582835 0.440238 Se\n0.494942 0.973573 0.750746 Se\n0.505058 0.473573 0.749254 Se\n0.505058 0.026427 0.249254 Se\n0.494942 0.526427 0.250746 Se\n0.497802 0.152349 0.919627 Se\n0.502198 0.652349 0.580373 Se\n0.502198 0.847651 0.080373 Se\n0.497802 0.347651 0.419627 Se\n0.487707 0.689652 0.881718 Se\n0.512293 0.189652 0.618282 Se\n0.512293 0.310348 0.118282 Se\n0.487707 0.810348 0.381718 Se\n0.699138 0.914977 0.571641 Se\n0.300862 0.414977 0.928359 Se\n0.300862 0.085023 0.428359 Se\n0.699138 0.585023 0.071641 Se\n",
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{
"id": "mp-28541",
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"structure_string": "Bi4 P8 O26\n1.0\n3.492624 6.080018 0.000000\n-3.492624 6.080018 0.000000\n0.000000 3.697818 12.870069\nBi P O\n4 8 26\ndirect\n0.696772 0.699045 0.941099 Bi\n0.300955 0.303228 0.558901 Bi\n0.303228 0.300955 0.058901 Bi\n0.699045 0.696772 0.441099 Bi\n0.865389 0.155113 0.636450 P\n0.844887 0.134611 0.863550 P\n0.134611 0.844887 0.363550 P\n0.155113 0.865389 0.136450 P\n0.762707 0.776605 0.658424 P\n0.223395 0.237293 0.841576 P\n0.237293 0.223395 0.341576 P\n0.776605 0.762707 0.158424 P\n0.766840 0.233160 0.750000 O\n0.233160 0.766840 0.250000 O\n0.688583 0.306532 0.934192 O\n0.693468 0.311417 0.565808 O\n0.311417 0.693468 0.065808 O\n0.306532 0.688583 0.434192 O\n0.881942 0.897338 0.893559 O\n0.102662 0.118058 0.606441 O\n0.118058 0.102662 0.106441 O\n0.897338 0.881942 0.393559 O\n0.899858 0.906669 0.655265 O\n0.093331 0.100142 0.844735 O\n0.306058 0.291915 0.228385 O\n0.708085 0.693942 0.271615 O\n0.693942 0.708085 0.771615 O\n0.291915 0.306058 0.728385 O\n0.925316 0.566706 0.095860 O\n0.433294 0.074684 0.404140 O\n0.074684 0.433294 0.904140 O\n0.566706 0.925316 0.595860 O\n0.580675 0.922078 0.097305 O\n0.077922 0.419325 0.402695 O\n0.419325 0.077922 0.902695 O\n0.922078 0.580675 0.597305 O\n0.906669 0.899858 0.155265 O\n0.100142 0.093331 0.344735 O\n",
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{
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"structure_string": "Ba1 Tm1 O3\n1.0\n4.374127 0.000000 0.000000\n0.000000 4.374127 0.000000\n0.000000 0.000000 4.374127\nBa Tm O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.500000 Tm\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
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{
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{
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{
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{
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{
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{
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