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"structure_string": "Fe2 O3 F1\n1.0\n4.379777 -0.132719 0.000000\n-0.132719 4.379777 0.000000\n0.000000 0.000000 2.859673\nFe O F\n2 3 1\ndirect\n0.023366 0.976634 0.000000 Fe\n0.479155 0.520845 0.499999 Fe\n0.198633 0.801368 0.499999 O\n0.300635 0.305294 0.000000 O\n0.694707 0.699366 0.000000 O\n0.803506 0.196494 0.499999 F\n",
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"structure_string": "Ca2 Ti4 O8\n1.0\n3.039531 0.001562 0.001805\n1.515593 7.200919 0.072620\n1.514649 1.179974 7.584060\nCa Ti O\n2 4 8\ndirect\n0.348826 0.151685 0.143229 Ca\n0.637811 0.884600 0.832391 Ca\n0.631679 0.563961 0.165308 Ti\n0.133070 0.212769 0.513704 Ti\n0.853591 0.823501 0.461915 Ti\n0.354975 0.472314 0.810305 Ti\n0.852107 0.617601 0.670777 O\n0.458586 0.778061 0.297367 O\n0.528073 0.258215 0.678252 O\n0.134535 0.418675 0.304847 O\n0.163345 0.676115 0.989813 O\n0.762822 0.101982 0.364968 O\n0.823323 0.360157 0.985796 O\n0.223841 0.934287 0.610652 O\n",
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