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{
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"structure_string": "Ca1 Co4 Cu3 O12\n1.0\n5.839803 -0.000000 -2.064682\n-2.919901 5.057418 -2.064682\n-0.000000 -0.000000 6.194046\nCa Co Cu O\n1 4 3 12\ndirect\n0.000000 0.000000 0.000000 Ca\n0.000000 0.000000 0.500000 Co\n0.000000 0.500000 0.000000 Co\n0.500000 0.500000 0.500001 Co\n0.500000 0.000000 0.000000 Co\n0.500000 0.500000 0.000000 Cu\n0.000000 0.500000 0.500001 Cu\n0.500000 0.000000 0.500000 Cu\n0.694519 0.517756 0.823237 O\n0.176764 0.305481 0.482244 O\n0.517756 0.823236 0.694520 O\n0.694519 0.871283 0.176765 O\n0.128717 0.823236 0.305482 O\n0.176764 0.694519 0.871284 O\n0.305481 0.482244 0.176764 O\n0.823236 0.694519 0.517757 O\n0.871283 0.176764 0.694520 O\n0.823236 0.305481 0.128717 O\n0.482244 0.176764 0.305481 O\n0.305481 0.128717 0.823237 O\n",
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"formula_full": "Ca1 Co3 Si4 O12",
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{
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{
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{
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"structure_string": "Ca4 C4 O12\n1.0\n4.485178 -0.000000 0.000000\n0.000000 6.567341 0.000000\n0.000000 0.000000 8.523621\nCa C O\n4 4 12\ndirect\n0.500000 0.500000 0.000000 Ca\n0.000000 0.000000 0.000000 Ca\n0.000000 0.000000 0.500000 Ca\n0.500000 0.500000 0.500000 Ca\n0.022405 0.631745 0.250000 C\n0.522405 0.868255 0.750000 C\n0.477595 0.131745 0.250000 C\n0.977595 0.368255 0.750000 C\n0.898007 0.679925 0.117367 O\n0.398007 0.820074 0.882633 O\n0.601994 0.179925 0.117367 O\n0.601994 0.179925 0.382633 O\n0.773748 0.963141 0.750000 O\n0.101993 0.320074 0.617367 O\n0.898007 0.679925 0.382633 O\n0.273747 0.536858 0.250000 O\n0.101993 0.320074 0.882633 O\n0.226253 0.036858 0.250000 O\n0.398007 0.820074 0.617367 O\n0.726253 0.463142 0.750000 O\n",
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