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"structure_string": "Ba4 Ni1 Mo1\n1.0\n0.000000 4.856076 4.856076\n4.856076 -0.000000 4.856076\n4.856076 4.856076 -0.000000\nBa Ni Mo\n4 1 1\ndirect\n0.124174 0.625276 0.625276 Ba\n0.625276 0.625276 0.625276 Ba\n0.625276 0.124174 0.625276 Ba\n0.625276 0.625276 0.124174 Ba\n0.000000 0.000000 0.000000 Ni\n0.250000 0.250000 0.250000 Mo\n",
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"structure_string": "Ba1 Tl1 Te1\n1.0\n-0.000000 4.012668 4.012668\n4.012668 0.000000 4.012668\n4.012668 4.012668 -0.000000\nBa Tl Te\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Te\n",
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