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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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"structure_string": "Ca4 Zn4 Cu2 P6\n1.0\n2.026239 -3.509547 0.000000\n2.026239 3.509547 -0.000000\n0.000000 0.000000 21.427027\nCa Zn Cu P\n4 4 2 6\ndirect\n0.000000 0.000000 0.658923 Ca\n0.000000 0.000000 0.341077 Ca\n0.000000 0.000000 0.158923 Ca\n0.000000 0.000000 0.841077 Ca\n0.333333 0.666667 0.956847 Zn\n0.666667 0.333333 0.456847 Zn\n0.666667 0.333333 0.043153 Zn\n0.333333 0.666667 0.543153 Zn\n0.666667 0.333333 0.750000 Cu\n0.333333 0.666667 0.250000 Cu\n0.666667 0.333333 0.576332 P\n0.333333 0.666667 0.423669 P\n0.333333 0.666667 0.750000 P\n0.666667 0.333333 0.923669 P\n0.333333 0.666667 0.076331 P\n0.666667 0.333333 0.250000 P\n",
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"structure_string": "Co8 P8 O28\n1.0\n6.535126 0.000000 -2.661145\n0.000000 8.266240 0.000000\n0.012445 0.000000 8.955669\nCo P O\n8 8 28\ndirect\n0.122241 0.073973 0.890336 Co\n0.375520 0.933146 0.678866 Co\n0.124481 0.433146 0.821135 Co\n0.624481 0.066854 0.321134 Co\n0.377760 0.573973 0.609664 Co\n0.622241 0.426027 0.390336 Co\n0.877760 0.926027 0.109664 Co\n0.875520 0.566854 0.178865 Co\n0.565428 0.275434 0.032855 P\n0.434573 0.724566 0.967144 P\n0.065428 0.224566 0.532856 P\n0.934573 0.775434 0.467144 P\n0.821702 0.765453 0.760103 P\n0.321701 0.734547 0.260103 P\n0.178300 0.234547 0.239897 P\n0.678300 0.265453 0.739897 P\n0.912193 0.254277 0.793938 O\n0.587808 0.754277 0.706062 O\n0.087808 0.745723 0.206062 O\n0.412193 0.245723 0.293938 O\n0.330340 0.264736 0.952252 O\n0.169661 0.764736 0.547748 O\n0.658074 0.110402 0.102832 O\n0.649708 0.331150 0.899515 O\n0.841927 0.610402 0.397168 O\n0.341927 0.889598 0.897168 O\n0.158074 0.389598 0.602832 O\n0.637280 0.412630 0.156779 O\n0.862721 0.912630 0.343221 O\n0.362721 0.587370 0.843221 O\n0.137280 0.087370 0.656779 O\n0.569683 0.105885 0.687849 O\n0.830340 0.235264 0.452252 O\n0.930319 0.605885 0.812151 O\n0.069682 0.394115 0.187849 O\n0.593337 0.402352 0.616384 O\n0.906665 0.902352 0.883616 O\n0.406664 0.597648 0.383616 O\n0.093336 0.097648 0.116384 O\n0.149707 0.168850 0.399515 O\n0.350294 0.668850 0.100485 O\n0.850294 0.831150 0.600485 O\n0.430319 0.894115 0.312151 O\n0.669661 0.735264 0.047748 O\n",
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{
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"structure_string": "Sc1 Mn1 Be1\n1.0\n1.495469 -2.590229 0.000000\n1.495469 2.590229 -0.000000\n0.000000 -0.000000 5.829862\nSc Mn Be\n1 1 1\ndirect\n0.333333 0.666668 0.671261 Sc\n0.666668 0.333333 0.298024 Mn\n-0.000000 0.000000 0.030715 Be\n",
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{
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