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"structure_string": "Li2 Bi1\n1.0\n4.786423 0.000000 -1.236963\n0.000000 3.443124 0.000000\n-1.316887 0.000000 4.759293\nLi Bi\n2 1\ndirect\n-0.199768 0.000000 -0.199608 Li\n0.133078 0.000000 0.466274 Li\n0.466690 0.000000 0.133333 Bi\n",
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"structure_string": "Ca1 Al1 F1\n1.0\n4.968011 -0.000000 -0.000000\n-2.484006 4.302424 0.000000\n-0.000000 -0.000000 3.406984\nCa Al F\n1 1 1\ndirect\n0.333333 0.666667 0.000000 Ca\n0.000000 0.000000 0.000000 Al\n0.666666 0.333333 0.000000 F\n",
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{
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"structure_string": "La2 N2\n1.0\n-0.000000 0.000000 3.663739\n4.458176 0.000000 -0.000000\n0.000000 4.458176 0.000000\nLa N\n2 2\ndirect\n0.272288 0.000000 0.500000 La\n0.727713 0.500000 0.000000 La\n0.000000 0.500000 0.500000 N\n0.000000 0.000000 0.000000 N\n",
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{
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"structure_string": "Hf1 Zr1 Zn2\n1.0\n-0.000004 3.314348 3.314350\n3.314351 0.000002 3.314345\n3.314353 3.314345 0.000000\nHf Zr Zn\n1 1 2\ndirect\n0.250001 0.250000 0.250001 Hf\n0.749999 0.750000 0.750000 Zr\n0.000000 0.000000 0.000000 Zn\n0.499998 0.499999 0.499999 Zn\n",
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{
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"structure_string": "Li1 Sc2 Pd1\n1.0\n4.058976 0.000000 2.343450\n1.352992 3.826838 2.343450\n0.000000 0.000000 4.686901\nLi Sc Pd\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.250000 0.250000 0.250000 Sc\n0.750000 0.750000 0.749999 Sc\n0.000000 0.000000 0.000000 Pd\n",
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{
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"structure_string": "Pu2 O3\n1.0\n1.881041 -3.258058 -0.000000\n1.881041 3.258058 -0.000000\n-0.000000 -0.000000 5.939152\nPu O\n2 3\ndirect\n0.333333 0.666667 0.758081 Pu\n0.666667 0.333333 0.241919 Pu\n0.000000 0.000000 0.000000 O\n0.333333 0.666667 0.358214 O\n0.666667 0.333333 0.641786 O\n",
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{
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{
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