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{
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{
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"structure_string": "Li4 Fe3 Sb5 O16\n1.0\n6.234456 0.000000 0.000000\n-3.013367 5.467701 0.000000\n-0.046524 -0.085821 10.357797\nLi Fe Sb O\n4 3 5 16\ndirect\n0.342002 0.676729 0.111031 Li\n0.003668 0.008402 0.009120 Li\n0.998524 0.998581 0.498206 Li\n0.679831 0.359153 0.604237 Li\n0.170631 0.338779 0.786625 Fe\n0.333485 0.163031 0.285661 Fe\n0.828196 0.163712 0.284651 Fe\n0.170293 0.836380 0.784226 Sb\n0.309750 0.638108 0.490283 Sb\n0.666951 0.834804 0.783762 Sb\n0.826485 0.657955 0.281129 Sb\n0.650654 0.303283 0.019882 Sb\n0.134900 0.819138 0.393405 O\n0.491337 0.989738 0.681994 O\n0.347950 0.692298 0.893557 O\n0.992576 0.987300 0.679497 O\n0.982817 0.981520 0.187680 O\n0.688198 0.837938 0.389359 O\n0.033661 0.535283 0.674156 O\n0.505680 0.532181 0.679206 O\n0.859670 0.708615 0.890650 O\n0.140401 0.303009 0.400066 O\n0.526175 0.496353 0.167368 O\n0.970752 0.482777 0.171268 O\n0.685346 0.350464 0.390538 O\n0.298246 0.133387 0.897902 O\n0.528077 0.037713 0.161965 O\n0.833445 0.133372 0.894732 O\n",
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"formula_full": "Li4 Fe3 Sb5 O16",
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{
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{
"id": "mp-556859",
"created_at": "2022-09-04T14:47:38.357877Z",
"structure_string": "Hg8 O8\n1.0\n5.822097 0.000000 0.000000\n0.000000 6.736417 0.000000\n0.000000 0.151477 7.426904\nHg O\n8 8\ndirect\n0.750000 0.121553 0.123994 Hg\n0.750000 0.113960 0.622039 Hg\n0.250000 0.886040 0.377961 Hg\n0.750000 0.613982 0.617276 Hg\n0.250000 0.386018 0.382724 Hg\n0.250000 0.378749 0.882392 Hg\n0.750000 0.621251 0.117608 Hg\n0.250000 0.878447 0.876006 Hg\n0.250000 0.134475 0.718653 O\n0.750000 0.858726 0.780272 O\n0.750000 0.365043 0.458465 O\n0.750000 0.865525 0.281347 O\n0.750000 0.371727 0.959553 O\n0.250000 0.628273 0.040447 O\n0.250000 0.141274 0.219728 O\n0.250000 0.634957 0.541535 O\n",
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{
"id": "mp-1034771",
"created_at": "2022-09-04T14:47:38.396482Z",
"structure_string": "Cs1 Hf1 Mg14 O15\n1.0\n9.056834 0.000000 0.000000\n0.000000 8.977048 0.000000\n0.000000 0.000000 4.329072\nCs Hf Mg O\n1 1 14 15\ndirect\n0.064424 -0.000000 -0.000000 Cs\n0.509287 0.500000 -0.000000 Hf\n0.982873 0.500000 -0.000000 Mg\n0.500012 -0.000000 -0.000000 Mg\n0.985992 0.253851 0.500000 Mg\n0.985992 0.746149 0.500000 Mg\n0.507811 0.243540 0.500000 Mg\n0.507811 0.756460 0.500000 Mg\n0.290363 -0.000000 0.500000 Mg\n0.231407 0.500000 0.500000 Mg\n0.739663 -0.000000 0.500000 Mg\n0.757910 0.500000 0.500000 Mg\n0.251718 0.266504 0.000000 Mg\n0.251718 0.733496 -0.000000 Mg\n0.757627 0.235307 0.000000 Mg\n0.757627 0.764693 -0.000000 Mg\n0.263448 0.500000 -0.000000 O\n0.720724 -0.000000 -0.000000 O\n0.743209 0.500000 -0.000000 O\n0.247473 0.256604 0.500000 O\n0.247473 0.743396 0.500000 O\n0.743512 0.258062 0.500000 O\n0.743512 0.741938 0.500000 O\n0.950758 -0.000000 0.500000 O\n0.995025 0.500000 0.500000 O\n0.512835 -0.000000 0.500000 O\n0.505856 0.500000 0.500000 O\n0.988629 0.281979 0.000000 O\n0.988629 0.718021 -0.000000 O\n0.508342 0.266042 -0.000000 O\n0.508342 0.733958 -0.000000 O\n",
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{
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{
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"structure_string": "Sm4 Ni4 O10\n1.0\n-2.680772 2.836573 7.668545\n2.680772 -2.836573 7.668545\n2.680772 2.836573 -7.668545\nSm Ni O\n4 4 10\ndirect\n0.872591 0.392496 0.482705 Sm\n0.127409 0.610114 0.519906 Sm\n0.409791 0.892496 0.519906 Sm\n0.590209 0.110114 0.482705 Sm\n0.000000 0.987098 0.987098 Ni\n0.500000 0.487098 0.987098 Ni\n0.806461 0.784319 0.090779 Ni\n0.193539 0.284319 0.977858 Ni\n0.763619 0.767744 0.486952 O\n0.236381 0.723333 0.004125 O\n0.780792 0.267744 0.004125 O\n0.219208 0.223333 0.486952 O\n0.779170 0.815194 0.869992 O\n0.220830 0.090822 0.036024 O\n0.445202 0.315194 0.036024 O\n0.554798 0.590822 0.869992 O\n0.853945 0.164879 0.518824 O\n0.146055 0.664879 0.310934 O\n",
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{
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{
"id": "mp-1043411",
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"structure_string": "Ca4 Si16 Sn4 O40\n1.0\n7.560482 0.000000 0.000000\n0.000000 7.560482 0.000000\n0.000000 0.000000 15.977857\nCa Si Sn O\n4 16 4 40\ndirect\n0.500000 0.500000 0.500000 Ca\n0.000000 0.000000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.000000 Ca\n0.158786 0.247020 0.652979 Si\n0.841214 0.752980 0.652979 Si\n0.247020 0.158786 0.847021 Si\n0.747020 0.341214 0.652979 Si\n0.252980 0.658786 0.652979 Si\n0.341214 0.747020 0.847021 Si\n0.658786 0.252980 0.847021 Si\n0.752980 0.841214 0.847021 Si\n0.341214 0.252980 0.347021 Si\n0.658786 0.747020 0.347021 Si\n0.252980 0.341214 0.152979 Si\n0.752980 0.158786 0.347021 Si\n0.247020 0.841214 0.347021 Si\n0.158786 0.752980 0.152979 Si\n0.841214 0.247020 0.152979 Si\n0.747020 0.658786 0.152979 Si\n0.500000 0.000000 0.540139 Sn\n0.000000 0.500000 0.959861 Sn\n0.000000 0.500000 0.459861 Sn\n0.500000 0.000000 0.040139 Sn\n0.230593 0.103327 0.586410 O\n0.769407 0.896673 0.586410 O\n0.103327 0.230593 0.913590 O\n0.603327 0.269407 0.586410 O\n0.396673 0.730593 0.586410 O\n0.269407 0.603327 0.913590 O\n0.730593 0.396673 0.913590 O\n0.896673 0.769407 0.913590 O\n0.269407 0.396673 0.413590 O\n0.730593 0.603327 0.413590 O\n0.396673 0.269407 0.086410 O\n0.896673 0.230593 0.413590 O\n0.103327 0.769407 0.413590 O\n0.230593 0.896673 0.086410 O\n0.769407 0.103327 0.086410 O\n0.256268 0.056175 0.364677 O\n0.603327 0.730593 0.086410 O\n0.756268 0.556175 0.635323 O\n0.443825 0.243732 0.864677 O\n0.943825 0.256268 0.635323 O\n0.056175 0.743732 0.635323 O\n0.256268 0.943825 0.864677 O\n0.743732 0.056175 0.864677 O\n0.556175 0.756268 0.864677 O\n0.694349 0.694349 0.250000 O\n0.805651 0.194349 0.250000 O\n0.194349 0.805651 0.250000 O\n0.305651 0.305651 0.250000 O\n0.805651 0.805651 0.750000 O\n0.694349 0.305651 0.750000 O\n0.305651 0.694349 0.750000 O\n0.194349 0.194349 0.750000 O\n0.943825 0.743732 0.135323 O\n0.756268 0.443825 0.135323 O\n0.243732 0.556175 0.135323 O\n0.443825 0.756268 0.364677 O\n0.556175 0.243732 0.364677 O\n0.056175 0.256268 0.135323 O\n0.743732 0.943825 0.364677 O\n0.243732 0.443825 0.635323 O\n",
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