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"structure_string": "Na1 Al1 O1\n1.0\n5.642942 -1.291498 0.000000\n-4.312441 3.862140 0.000000\n0.000000 0.000000 3.319082\nNa Al O\n1 1 1\ndirect\n0.026570 0.306483 0.000000 Na\n0.285552 0.047949 0.000000 Al\n0.687877 0.645567 0.000000 O\n",
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"structure_string": "Ba1 Cd1 Se1\n1.0\n6.889630 -1.284602 0.000000\n-0.635002 4.453577 0.000000\n0.000000 0.000000 4.786680\nBa Cd Se\n1 1 1\ndirect\n-0.179075 -0.209469 0.000000 Ba\n0.412199 0.086200 0.000000 Cd\n0.140913 0.450353 0.000000 Se\n",
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"structure_string": "Cd1 In1 Se1\n1.0\n8.366464 2.559470 0.000000\n1.855258 3.636260 0.000000\n0.000000 0.000000 3.128958\nCd In Se\n1 1 1\ndirect\n0.449677 0.129548 0.000000 Cd\n-0.185214 0.079825 0.000000 In\n0.138126 0.096335 0.000000 Se\n",
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"structure_string": "Ca2 Ga1 Si1\n1.0\n5.916616 0.001346 0.000000\n-4.261171 4.104725 0.000000\n0.000000 0.000000 4.098433\nCa Ga Si\n2 1 1\ndirect\n0.360335 0.639664 0.500000 Ca\n0.640928 0.359073 0.000000 Ca\n0.069266 0.930733 0.500000 Ga\n0.929473 0.070529 0.000000 Si\n",
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"structure_string": "Na1 Bi3 Br2 O4\n1.0\n6.904504 0.030005 0.000000\n-4.645629 5.107955 0.000000\n-0.000000 -0.000000 5.604284\nNa Bi Br O\n1 3 2 4\ndirect\n0.344881 0.655117 0.500000 Na\n0.840743 0.159255 -0.000000 Bi\n0.161622 0.838377 -0.000000 Bi\n0.660554 0.339444 0.500000 Bi\n0.494601 0.505397 -0.000000 Br\n0.003002 0.996997 0.500000 Br\n0.505776 0.008479 0.756400 O\n0.991519 0.494222 0.243600 O\n0.991519 0.494222 0.756400 O\n0.505776 0.008479 0.243600 O\n",
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"structure_string": "Ba2 Te1\n1.0\n6.448527 0.850841 -2.296102\n-2.270795 -5.193760 -3.678309\n0.099947 -3.290716 -7.826255\nBa Te\n2 1\ndirect\n0.584239 0.366554 0.245863 Ba\n0.321853 0.076215 0.008253 Ba\n0.042381 0.240788 0.287638 Te\n",
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{
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"structure_string": "Na3 Se1\n1.0\n3.977003 -0.414576 0.353239\n-0.852463 -7.895594 0.342584\n0.218686 -1.381194 -4.083933\nNa Se\n3 1\ndirect\n0.898825 0.894302 0.010774 Na\n0.398742 0.262558 0.326989 Na\n0.398610 0.583252 0.666661 Na\n0.898651 0.528600 0.193957 Se\n",
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"structure_string": "Ba1 Si1 Cl1\n1.0\n5.031846 1.742078 0.000000\n1.788826 5.976149 0.000000\n0.000000 0.000000 3.837480\nBa Si Cl\n1 1 1\ndirect\n0.119518 -0.213080 0.000000 Ba\n-0.151772 0.422037 0.000000 Si\n0.369410 0.162150 0.000000 Cl\n",
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