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"structure_string": "B1 As1 Pb1\n1.0\n0.000000 3.169911 3.169911\n3.169911 0.000000 3.169911\n3.169911 3.169911 0.000000\nB As Pb\n1 1 1\ndirect\n0.750000 0.750000 0.750000 B\n0.500000 0.500000 0.500000 As\n0.000000 0.000000 0.000000 Pb\n",
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{
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"structure_string": "B1 Br1 N1\n1.0\n2.613982 0.000000 0.000000\n0.000000 5.455845 0.000000\n0.000000 0.000000 4.122332\nB Br N\n1 1 1\ndirect\n0.000000 0.000000 -0.013406 B\n0.500000 0.500000 0.486785 Br\n0.500000 0.000000 -0.013380 N\n",
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{
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"structure_string": "B1 Br1 N2\n1.0\n2.667285 0.000000 0.000000\n0.000000 2.667285 0.000000\n0.000000 0.000000 6.085138\nB Br N\n1 1 2\ndirect\n0.499999 0.499999 0.573918 B\n0.000000 0.000000 0.154063 Br\n0.000000 0.000000 0.479064 N\n0.499999 0.499999 0.802956 N\n",
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"structure_string": "B1 Br2\n1.0\n3.937706 -0.280176 0.394636\n0.518596 -5.867513 0.184436\n-1.351410 0.253110 -3.722997\nB Br\n1 2\ndirect\n0.054292 0.876172 0.946264 B\n0.157072 0.549256 0.939770 Br\n0.593194 0.019561 0.533874 Br\n",
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{
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"structure_string": "B1 Br2\n1.0\n4.033825 0.000000 0.000000\n0.000000 3.853084 0.000000\n0.000000 0.000000 6.927600\nB Br\n1 2\ndirect\n0.288971 0.000000 0.000000 B\n0.055515 0.000000 0.763439 Br\n0.055515 0.000000 0.236562 Br\n",
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{
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{
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