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{
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{
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{
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{
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{
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"structure_string": "Ca12 Hf38 O88\n1.0\n7.926591 -9.130836 0.000000\n7.926591 9.130836 0.000000\n-2.591445 0.000000 11.810480\nCa Hf O\n12 38 88\ndirect\n0.049667 0.450333 0.250000 Ca\n0.333902 0.166098 0.750000 Ca\n0.166098 0.750000 0.333902 Ca\n0.750000 0.333902 0.166098 Ca\n0.250000 0.049667 0.450333 Ca\n0.950333 0.549667 0.750000 Ca\n0.549667 0.750000 0.950333 Ca\n0.250000 0.666098 0.833902 Ca\n0.833902 0.250000 0.666098 Ca\n0.450333 0.250000 0.049667 Ca\n0.750000 0.950333 0.549667 Ca\n0.666098 0.833902 0.250000 Ca\n0.357370 0.750000 0.142630 Hf\n0.857764 0.423944 0.449326 Hf\n0.448317 0.621151 0.657688 Hf\n0.050674 0.076056 0.642236 Hf\n0.157688 0.121151 0.948317 Hf\n0.062002 0.250000 0.437998 Hf\n0.342312 0.551683 0.378849 Hf\n0.449326 0.857764 0.423944 Hf\n0.562002 0.937998 0.750000 Hf\n0.142630 0.357370 0.750000 Hf\n0.437998 0.062002 0.250000 Hf\n0.551683 0.378849 0.342312 Hf\n0.250000 0.857370 0.642630 Hf\n0.051683 0.842312 0.878849 Hf\n0.642630 0.250000 0.857370 Hf\n0.378849 0.342312 0.551683 Hf\n0.250000 0.250000 0.250000 Hf\n0.121151 0.948317 0.157688 Hf\n0.357764 0.949326 0.923944 Hf\n0.948317 0.157688 0.121151 Hf\n0.576056 0.550674 0.142236 Hf\n0.657688 0.448317 0.621151 Hf\n0.621151 0.657688 0.448317 Hf\n0.878849 0.051683 0.842312 Hf\n0.750000 0.142630 0.357370 Hf\n0.423944 0.449326 0.857764 Hf\n0.642236 0.050674 0.076056 Hf\n0.750000 0.562002 0.937998 Hf\n0.937998 0.750000 0.562002 Hf\n0.857370 0.642630 0.250000 Hf\n0.949326 0.923944 0.357764 Hf\n0.550674 0.142236 0.576056 Hf\n0.750000 0.750000 0.750000 Hf\n0.250000 0.437998 0.062002 Hf\n0.923944 0.357764 0.949326 Hf\n0.142236 0.576056 0.550674 Hf\n0.076056 0.642236 0.050674 Hf\n0.842312 0.878849 0.051683 Hf\n0.108754 0.745024 0.566536 O\n0.392879 0.392879 0.392879 O\n0.456178 0.685467 0.494644 O\n0.200634 0.847982 0.801371 O\n0.106840 0.914627 0.317865 O\n0.929630 0.747967 0.734260 O\n0.685467 0.494644 0.456178 O\n0.959022 0.920180 0.549145 O\n0.254976 0.433464 0.891246 O\n0.652018 0.299366 0.698629 O\n0.801420 0.985360 0.368907 O\n0.301371 0.347982 0.700634 O\n0.070370 0.252033 0.265740 O\n0.847982 0.801371 0.200634 O\n0.494644 0.456178 0.685467 O\n0.956178 0.994644 0.185467 O\n0.301420 0.868907 0.485360 O\n0.606840 0.817865 0.414627 O\n0.198629 0.799366 0.152018 O\n0.752033 0.570370 0.765740 O\n0.433464 0.891246 0.254976 O\n0.265740 0.070370 0.252033 O\n0.198580 0.014640 0.631093 O\n0.514640 0.698580 0.131093 O\n0.368907 0.801420 0.985360 O\n0.920180 0.549145 0.959022 O\n0.066536 0.245024 0.608754 O\n0.247967 0.429630 0.234260 O\n0.700634 0.301371 0.347982 O\n0.185467 0.956178 0.994644 O\n0.892879 0.892879 0.892879 O\n0.754976 0.391246 0.933464 O\n0.893160 0.085373 0.682135 O\n0.347982 0.700634 0.301371 O\n0.234260 0.247967 0.429630 O\n0.393160 0.182135 0.585373 O\n0.985360 0.368907 0.801420 O\n0.950855 0.579820 0.540978 O\n0.040978 0.079820 0.450855 O\n0.566536 0.108754 0.745024 O\n0.414627 0.606840 0.817865 O\n0.450855 0.040978 0.079820 O\n0.049145 0.420180 0.459022 O\n0.994644 0.185467 0.956178 O\n0.814533 0.043822 0.005356 O\n0.933464 0.754976 0.391246 O\n0.891246 0.254976 0.433464 O\n0.608754 0.066536 0.245024 O\n0.131093 0.514640 0.698580 O\n0.631093 0.198580 0.014640 O\n0.765740 0.752033 0.570370 O\n0.317865 0.106840 0.914627 O\n0.817865 0.414627 0.606840 O\n0.182135 0.585373 0.393160 O\n0.459022 0.049145 0.420180 O\n0.698580 0.131093 0.514640 O\n0.505356 0.543822 0.314533 O\n0.799366 0.152018 0.198629 O\n0.745024 0.566536 0.108754 O\n0.914627 0.317865 0.106840 O\n0.085373 0.682135 0.893160 O\n0.868907 0.485360 0.301420 O\n0.005356 0.814533 0.043822 O\n0.543822 0.314533 0.505356 O\n0.485360 0.301420 0.868907 O\n0.607121 0.607121 0.607121 O\n0.043822 0.005356 0.814533 O\n0.734260 0.929630 0.747967 O\n0.429630 0.234260 0.247967 O\n0.682135 0.893160 0.085373 O\n0.107121 0.107121 0.107121 O\n0.252033 0.265740 0.070370 O\n0.079820 0.450855 0.040978 O\n0.570370 0.765740 0.752033 O\n0.747967 0.734260 0.929630 O\n0.549145 0.959022 0.920180 O\n0.420180 0.459022 0.049145 O\n0.698629 0.652018 0.299366 O\n0.801371 0.200634 0.847982 O\n0.299366 0.698629 0.652018 O\n0.391246 0.933464 0.754976 O\n0.579820 0.540978 0.950855 O\n0.245024 0.608754 0.066536 O\n0.152018 0.198629 0.799366 O\n0.540978 0.950855 0.579820 O\n0.014640 0.631093 0.198580 O\n0.585373 0.393160 0.182135 O\n0.314533 0.505356 0.543822 O\n",
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