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{
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{
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"structure_string": "Ba2 Cu8 O8\n1.0\n6.638832 0.000000 0.000000\n0.000000 6.638832 0.000000\n0.000000 0.000000 6.286437\nBa Cu O\n2 8 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.000000 Ba\n0.750000 0.250000 0.500000 Cu\n0.250000 0.750000 0.500000 Cu\n0.750000 0.750000 0.500000 Cu\n0.250000 0.250000 0.500000 Cu\n0.500000 0.000000 0.742156 Cu\n0.500000 0.000000 0.257844 Cu\n0.000000 0.500000 0.257844 Cu\n0.000000 0.500000 0.742156 Cu\n0.809179 0.309179 0.771580 O\n0.690821 0.190821 0.228420 O\n0.190821 0.690821 0.771580 O\n0.309179 0.809179 0.228420 O\n0.309179 0.190821 0.771580 O\n0.809179 0.690821 0.228420 O\n0.190821 0.309179 0.228420 O\n0.690821 0.809179 0.771580 O\n",
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{
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{
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"structure_string": "Ca4 Sn8 O16\n1.0\n3.236916 0.000000 0.000000\n0.000000 10.858250 0.000000\n0.000000 0.000000 11.451291\nCa Sn O\n4 8 16\ndirect\n0.262537 0.750691 0.643105 Ca\n0.262537 0.250691 0.856895 Ca\n0.737463 0.750691 0.143105 Ca\n0.737463 0.250691 0.356895 Ca\n0.760394 0.581810 0.890563 Sn\n0.760394 0.081810 0.609437 Sn\n0.239606 0.081810 0.109437 Sn\n0.753867 0.428115 0.619864 Sn\n0.246133 0.428115 0.119864 Sn\n0.753867 0.928115 0.880136 Sn\n0.246133 0.928115 0.380136 Sn\n0.239606 0.581810 0.390563 Sn\n0.255674 0.875933 0.000741 O\n0.755011 0.109415 0.957715 O\n0.254693 0.989875 0.777631 O\n0.744326 0.875933 0.500741 O\n0.755011 0.609415 0.542285 O\n0.760582 0.264010 0.712268 O\n0.244989 0.109415 0.457715 O\n0.239418 0.264010 0.212268 O\n0.254693 0.489875 0.722369 O\n0.745307 0.989875 0.277631 O\n0.244989 0.609415 0.042285 O\n0.239418 0.764010 0.287732 O\n0.760582 0.764010 0.787732 O\n0.745307 0.489875 0.222369 O\n0.255674 0.375933 0.499259 O\n0.744326 0.375933 0.999259 O\n",
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{
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{
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{
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"structure_string": "Ta2 Zn4 Cu2 O12\n1.0\n7.433383 0.000000 0.000000\n0.000000 5.393275 0.000000\n0.000000 1.124968 5.507264\nTa Zn Cu O\n2 4 2 12\ndirect\n0.000000 0.000000 0.500000 Ta\n0.500000 0.000000 0.500000 Ta\n0.750000 0.967768 0.044369 Zn\n0.750000 0.488335 0.557974 Zn\n0.250000 0.511665 0.442026 Zn\n0.250000 0.032232 0.955631 Zn\n0.000000 0.500000 0.000000 Cu\n0.500000 0.500000 0.000000 Cu\n0.441609 0.178267 0.159076 O\n0.574439 0.715481 0.350362 O\n0.558391 0.821733 0.840924 O\n0.074439 0.284519 0.649638 O\n0.250000 0.856063 0.536378 O\n0.425561 0.284519 0.649638 O\n0.925561 0.715481 0.350362 O\n0.058391 0.178267 0.159076 O\n0.750000 0.372056 0.927839 O\n0.941609 0.821733 0.840924 O\n0.250000 0.627944 0.072161 O\n0.750000 0.143937 0.463622 O\n",
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{
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