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{
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{
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{
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"structure_string": "Nd2 Ta2 O8\n1.0\n4.848898 0.004869 -1.775062\n-1.338121 4.957321 -2.087937\n-0.006225 0.006400 6.716472\nNd Ta O\n2 2 8\ndirect\n0.381647 0.631647 0.263294 Nd\n0.618354 0.368353 0.736706 Nd\n0.849269 0.099269 0.198538 Ta\n0.150732 0.900731 0.801462 Ta\n0.997218 0.795141 0.062931 O\n0.565714 0.267790 0.062931 O\n0.002784 0.204859 0.937069 O\n0.434288 0.732210 0.937069 O\n0.197264 0.357401 0.413488 O\n0.716225 0.056087 0.413488 O\n0.802737 0.642599 0.586512 O\n0.283777 0.943913 0.586512 O\n",
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"structure_string": "Li4 Ti2 Fe4 O10\n1.0\n4.383478 -2.562450 -0.112065\n1.397713 -0.795660 4.769844\n-1.518289 -7.629441 -0.027689\nLi Ti Fe O\n4 2 4 10\ndirect\n0.200145 0.000014 0.599677 Li\n0.002734 0.999989 0.994581 Li\n0.699816 0.500018 0.600322 Li\n0.897310 0.499994 0.205416 Li\n0.099411 0.500008 0.801159 Ti\n0.800572 0.000010 0.398838 Ti\n0.304034 0.499997 0.391946 Fe\n0.490923 0.499990 0.018148 Fe\n0.595978 0.000007 0.808061 Fe\n0.409082 0.999994 0.181848 Fe\n0.949993 0.749997 0.600003 O\n0.046890 0.237965 0.397482 O\n0.344370 0.737962 0.802521 O\n0.449997 0.249996 0.599998 O\n0.125149 0.761168 0.208199 O\n0.233334 0.261175 0.991801 O\n0.853106 0.262025 0.802517 O\n0.666672 0.238821 0.208195 O\n0.555625 0.762027 0.397480 O\n0.774860 0.738825 0.991804 O\n",
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{
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"structure_string": "Li2 Ni2 Sn2 O8\n1.0\n2.889782 -2.839497 -4.505193\n3.033306 2.916084 4.460654\n2.723463 -2.999391 4.505193\nLi Ni Sn O\n2 2 2 8\ndirect\n0.000001 0.500000 0.000000 Li\n0.500000 -0.000001 0.500000 Li\n-0.000000 -0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Sn\n0.500000 0.499999 0.500000 Sn\n0.229434 0.007661 0.745779 O\n0.204360 0.441516 0.292171 O\n0.245779 0.492338 0.729434 O\n0.207830 0.941516 0.295641 O\n0.792170 0.058483 0.704360 O\n0.754221 0.507661 0.270566 O\n0.795641 0.558483 0.707830 O\n0.770566 0.992338 0.254222 O\n",
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{
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"structure_string": "Ca4 Re4 N12\n1.0\n-3.078018 5.165935 -1.625504\n0.072911 -0.008206 -7.324004\n-5.199470 -5.093293 0.818715\nCa Re N\n4 4 12\ndirect\n0.750001 0.915363 0.915364 Ca\n0.750001 0.304464 0.304465 Ca\n0.250000 0.084635 0.084636 Ca\n0.250000 0.695534 0.695535 Ca\n0.261900 0.619243 0.200119 Re\n0.238100 0.200119 0.619244 Re\n0.738100 0.380755 0.799881 Re\n0.761901 0.799880 0.380757 Re\n0.539065 0.656445 0.361117 N\n0.338364 0.384523 0.112158 N\n0.658838 0.992647 0.229035 N\n0.161637 0.112157 0.384523 N\n0.838364 0.887841 0.615477 N\n0.341163 0.007352 0.770965 N\n0.841163 0.229033 0.992647 N\n0.158837 0.770965 0.007353 N\n0.661637 0.615475 0.887842 N\n0.960936 0.361115 0.656446 N\n0.039065 0.638883 0.343554 N\n0.460936 0.343553 0.638883 N\n",
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"structure_string": "Bi2 Sb2 O8\n1.0\n4.624058 -0.000000 -1.878551\n-0.566834 5.320683 -1.395265\n-0.035801 -0.045114 6.542218\nBi Sb O\n2 2 8\ndirect\n0.753904 0.250000 0.500000 Bi\n0.246097 0.750000 0.500000 Bi\n0.000000 0.000000 0.000000 Sb\n0.500001 0.500000 -0.000000 Sb\n0.810188 0.536505 0.308533 O\n0.001655 0.963495 0.691466 O\n0.189814 0.463495 0.691467 O\n0.998347 0.036505 0.308534 O\n0.365406 0.829796 0.131412 O\n0.733994 0.670203 0.868588 O\n0.634596 0.170204 0.868589 O\n0.266007 0.329797 0.131412 O\n",
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"structure_string": "Nd2 Nb2 O8\n1.0\n4.887937 0.019793 -1.846714\n-1.233758 4.943717 -2.089099\n-0.020699 0.000718 6.775720\nNd Nb O\n2 2 8\ndirect\n0.121109 0.371110 0.742219 Nd\n0.878891 0.628890 0.257781 Nd\n0.644358 0.894358 0.788717 Nb\n0.355642 0.105642 0.211284 Nb\n0.785654 0.945248 0.583673 O\n0.298018 0.638425 0.583672 O\n0.214346 0.054752 0.416328 O\n0.701982 0.361576 0.416328 O\n0.081025 0.275007 0.064600 O\n0.483574 0.789594 0.064600 O\n0.918975 0.724993 0.935400 O\n0.516426 0.210407 0.935400 O\n",
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"structure_string": "Pb2 Cl8\n1.0\n5.104712 -0.000365 1.434126\n2.315998 5.957336 1.557105\n-0.008666 0.070504 9.835838\nPb Cl\n2 8\ndirect\n0.253381 0.750023 0.249986 Pb\n0.746618 0.249976 0.750015 Pb\n0.121652 0.419858 0.315544 Cl\n0.878348 0.580142 0.684457 Cl\n0.617605 0.185043 0.549388 Cl\n0.351991 0.314913 0.950634 Cl\n0.857081 0.080150 0.184474 Cl\n0.142919 0.919849 0.815528 Cl\n0.382394 0.814957 0.450613 Cl\n0.648007 0.685086 0.049367 Cl\n",
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{
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"structure_string": "Li4 Fe2 Si4 O12\n1.0\n2.893180 4.838509 0.119996\n-2.893180 4.838509 -0.119996\n-0.208719 0.000000 9.204192\nLi Fe Si O\n4 2 4 12\ndirect\n0.606672 0.719794 0.881221 Li\n0.280206 0.393328 0.381221 Li\n0.719794 0.606672 0.618779 Li\n0.393328 0.280206 0.118779 Li\n0.249375 0.249375 0.750000 Fe\n0.750625 0.750625 0.250000 Fe\n0.137171 0.795294 0.633943 Si\n0.204706 0.862829 0.133943 Si\n0.795294 0.137171 0.866056 Si\n0.862829 0.204706 0.366056 Si\n0.759132 0.516975 0.414180 O\n0.483025 0.240868 0.914180 O\n0.000000 0.000000 0.000000 O\n0.122387 0.122387 0.250000 O\n-0.000000 0.000000 0.500000 O\n0.367839 0.853269 0.707605 O\n0.516975 0.759132 0.085820 O\n0.240868 0.483025 0.585820 O\n0.146731 0.632161 0.207605 O\n0.853269 0.367839 0.792395 O\n0.877613 0.877613 0.750000 O\n0.632161 0.146731 0.292395 O\n",
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}