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"structure_string": "Ba4 Tc1 Hg1\n1.0\n-0.000000 4.798806 4.798806\n4.798806 -0.000000 4.798806\n4.798806 4.798806 0.000000\nBa Tc Hg\n4 1 1\ndirect\n0.123154 0.625616 0.625616 Ba\n0.625616 0.625616 0.625616 Ba\n0.625616 0.123154 0.625616 Ba\n0.625616 0.625616 0.123154 Ba\n0.000000 0.000000 0.000000 Tc\n0.250000 0.250000 0.250000 Hg\n",
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