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"structure_string": "Ba4 Al4 H20\n1.0\n9.207352 0.000000 0.000000\n0.000000 7.042981 0.000000\n0.000000 0.000000 5.094183\nBa Al H\n4 4 20\ndirect\n0.186008 0.345454 0.253997 Ba\n0.813991 0.654545 0.753997 Ba\n0.313991 0.845454 0.753997 Ba\n0.686008 0.154545 0.253997 Ba\n0.540951 0.654210 0.228981 Al\n0.459049 0.345790 0.728981 Al\n0.959048 0.154210 0.728981 Al\n0.040951 0.845790 0.228981 Al\n0.578307 0.788084 0.501913 H\n0.859346 0.803876 0.234459 H\n0.140654 0.196124 0.734459 H\n0.793695 0.043971 0.714497 H\n0.359346 0.696124 0.234459 H\n0.206305 0.956029 0.214497 H\n0.421693 0.211915 0.001913 H\n0.640654 0.303876 0.734459 H\n0.921693 0.288084 0.001913 H\n0.916271 0.343605 0.523827 H\n0.583729 0.843605 0.023828 H\n0.416271 0.156395 0.523827 H\n0.293695 0.456029 0.714497 H\n0.083729 0.656395 0.023828 H\n0.007157 0.948692 0.909324 H\n0.992843 0.051307 0.409324 H\n0.492843 0.448692 0.409324 H\n0.507157 0.551307 0.909324 H\n0.078307 0.711915 0.501913 H\n0.706305 0.543971 0.214497 H\n",
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"structure_string": "Be1 Cd2 Ir1\n1.0\n3.932539 0.000000 -0.000000\n-0.000000 3.932539 0.000000\n-0.000000 0.000000 4.131124\nBe Cd Ir\n1 2 1\ndirect\n0.000000 0.000000 0.499999 Be\n0.000000 0.500000 0.000000 Cd\n0.500000 0.000000 0.000000 Cd\n0.500000 0.500000 0.499999 Ir\n",
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"structure_string": "Ba1 Fe2 S4\n1.0\n4.592651 0.170508 2.427811\n2.135000 5.620024 1.131933\n-0.290983 0.082239 6.110051\nBa Fe S\n1 2 4\ndirect\n0.750000 -0.000047 0.000047 Ba\n0.250000 0.499940 0.500060 Fe\n0.750000 0.500058 0.499942 Fe\n0.154059 0.500020 0.192120 S\n0.345941 0.807880 0.499979 S\n0.654069 0.192133 0.499983 S\n0.845931 0.500016 0.807867 S\n",
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"structure_string": "La1 Sb1\n1.0\n3.997844 0.000000 2.308156\n1.332614 3.769204 2.308156\n0.000000 0.000000 4.616313\nLa Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.499999 0.499999 0.500001 Sb\n",
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"structure_string": "Be1 Ga2 Co1\n1.0\n-1.781291 1.781291 3.773595\n1.781291 -1.781291 3.773595\n1.781291 1.781291 -3.773595\nBe Ga Co\n1 2 1\ndirect\n0.500001 0.500001 0.000000 Be\n0.000000 0.000000 0.000000 Ga\n0.250000 0.750000 0.500000 Ga\n0.750000 0.250000 0.500000 Co\n",
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