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"structure_string": "Ca1 Mo4 O8\n1.0\n5.306375 0.148014 4.350780\n2.145187 4.855687 4.350780\n0.220425 0.148014 6.858449\nCa Mo O\n1 4 8\ndirect\n0.500001 0.500000 0.499999 Ca\n0.500002 0.999999 0.500001 Mo\n0.999999 0.499999 0.500002 Mo\n0.500000 0.500000 0.000000 Mo\n0.000000 0.000000 0.000000 Mo\n0.760567 0.262390 0.760567 O\n0.239434 0.239433 0.737610 O\n0.239433 0.737610 0.239433 O\n0.737609 0.239433 0.239434 O\n0.263937 0.263937 0.263937 O\n0.736064 0.736063 0.736064 O\n0.262392 0.760567 0.760566 O\n0.760567 0.760567 0.262391 O\n",
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"structure_string": "Ba1 Zn2 N2\n1.0\n3.647381 0.000000 -0.000004\n-1.823693 3.158726 -0.000000\n0.000000 0.000000 6.598153\nBa Zn N\n1 2 2\ndirect\n-0.000000 -0.000000 0.500000 Ba\n0.666667 0.333333 0.121301 Zn\n0.333334 0.666668 0.878699 Zn\n0.666667 0.333333 0.791466 N\n0.333334 0.666668 0.208534 N\n",
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