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{
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{
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{
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"structure_string": "La10 P2 Pb6\n1.0\n4.830423 -8.366538 0.000000\n4.830423 8.366538 0.000000\n0.000000 0.000000 7.321271\nLa P Pb\n10 2 6\ndirect\n0.763832 0.763832 0.250000 La\n0.236168 0.000000 0.250000 La\n0.000000 0.236168 0.250000 La\n0.236168 0.236168 0.750000 La\n0.763832 0.000000 0.750000 La\n0.000000 0.763832 0.750000 La\n0.666667 0.333333 0.500000 La\n0.333333 0.666667 0.500000 La\n0.333333 0.666667 0.000000 La\n0.666667 0.333333 0.000000 La\n0.000000 0.000000 0.500000 P\n0.000000 0.000000 0.000000 P\n0.401917 0.401917 0.250000 Pb\n0.598083 0.000000 0.250000 Pb\n0.000000 0.598083 0.250000 Pb\n0.598083 0.598083 0.750000 Pb\n0.401917 0.000000 0.750000 Pb\n0.000000 0.401917 0.750000 Pb\n",
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{
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{
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{
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"structure_string": "Ca12 B24 S48\n1.0\n11.249450 0.000000 0.000000\n0.000000 11.249450 0.000000\n0.000000 0.000000 11.249450\nCa B S\n12 24 48\ndirect\n0.373595 0.126405 0.873595 Ca\n0.126405 0.873595 0.373595 Ca\n0.873595 0.373595 0.126405 Ca\n0.626405 0.626405 0.626405 Ca\n0.626405 0.873595 0.126405 Ca\n0.873595 0.126405 0.626405 Ca\n0.126405 0.626405 0.873595 Ca\n0.373595 0.373595 0.373595 Ca\n0.000000 0.500000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n0.500000 0.000000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.629382 0.193436 0.145989 B\n0.129382 0.306564 0.854011 B\n0.370618 0.693436 0.354011 B\n0.306564 0.854011 0.129382 B\n0.354011 0.370618 0.693436 B\n0.854011 0.129382 0.306564 B\n0.193436 0.145989 0.629382 B\n0.145989 0.629382 0.193436 B\n0.693436 0.354011 0.370618 B\n0.806564 0.645989 0.870618 B\n0.645989 0.870618 0.806564 B\n0.870618 0.806564 0.645989 B\n0.370618 0.806564 0.854011 B\n0.870618 0.693436 0.145989 B\n0.629382 0.306564 0.645989 B\n0.693436 0.145989 0.870618 B\n0.645989 0.629382 0.306564 B\n0.145989 0.870618 0.693436 B\n0.806564 0.854011 0.370618 B\n0.854011 0.370618 0.806564 B\n0.306564 0.645989 0.629382 B\n0.193436 0.354011 0.129382 B\n0.354011 0.129382 0.193436 B\n0.129382 0.193436 0.354011 B\n0.584939 0.277303 0.479573 S\n0.084939 0.222697 0.520427 S\n0.415061 0.777303 0.020427 S\n0.222697 0.520427 0.084939 S\n0.020427 0.415061 0.777303 S\n0.520427 0.084939 0.222697 S\n0.277303 0.479573 0.584939 S\n0.479573 0.584939 0.277303 S\n0.777303 0.020427 0.415061 S\n0.722697 0.979573 0.915061 S\n0.979573 0.915061 0.722697 S\n0.915061 0.722697 0.979573 S\n0.415061 0.722697 0.520427 S\n0.915061 0.777303 0.479573 S\n0.584939 0.222697 0.979573 S\n0.777303 0.479573 0.915061 S\n0.979573 0.584939 0.222697 S\n0.479573 0.915061 0.777303 S\n0.722697 0.520427 0.415061 S\n0.520427 0.415061 0.722697 S\n0.222697 0.979573 0.584939 S\n0.277303 0.020427 0.084939 S\n0.020427 0.084939 0.277303 S\n0.084939 0.277303 0.020427 S\n0.850940 0.288142 0.371737 S\n0.350940 0.211858 0.628263 S\n0.149060 0.788142 0.128263 S\n0.211858 0.628263 0.350940 S\n0.128263 0.149060 0.788142 S\n0.628263 0.350940 0.211858 S\n0.288142 0.371737 0.850940 S\n0.371737 0.850940 0.288142 S\n0.788142 0.128263 0.149060 S\n0.711858 0.871737 0.649060 S\n0.871737 0.649060 0.711858 S\n0.649060 0.711858 0.871737 S\n0.149060 0.711858 0.628263 S\n0.649060 0.788142 0.371737 S\n0.850940 0.211858 0.871737 S\n0.788142 0.371737 0.649060 S\n0.871737 0.850940 0.211858 S\n0.371737 0.649060 0.788142 S\n0.711858 0.628263 0.149060 S\n0.628263 0.149060 0.711858 S\n0.211858 0.871737 0.850940 S\n0.288142 0.128263 0.350940 S\n0.128263 0.350940 0.288142 S\n0.350940 0.288142 0.128263 S\n",
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{
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{
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{
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}