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"structure_string": "Br8 O4\n1.0\n3.876336 0.000000 0.000000\n0.000000 6.776501 0.000000\n0.000000 0.000000 10.334601\nBr O\n8 4\ndirect\n0.640192 0.320519 0.507466 Br\n0.359809 0.820519 0.492534 Br\n0.859809 0.320519 0.007466 Br\n0.140192 0.820519 0.992534 Br\n0.095964 0.496447 0.227335 Br\n0.904037 -0.003553 0.772665 Br\n0.404036 0.496447 0.727335 Br\n0.595965 -0.003553 0.272665 Br\n0.350381 0.704934 0.147713 O\n0.649620 0.204935 0.852287 O\n0.149619 0.704934 0.647713 O\n0.850382 0.204935 0.352287 O\n",
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"structure_string": "Br1 O2\n1.0\n4.813982 0.000000 -0.103437\n0.000000 3.032427 0.000000\n-0.071868 0.000000 3.940404\nBr O\n1 2\ndirect\n0.583552 0.000000 -0.039566 Br\n-0.141533 0.000000 -0.469023 O\n-0.042019 0.000000 -0.091411 O\n",
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{
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"structure_string": "Br2 O1\n1.0\n4.014662 0.863785 -0.563438\n-1.566409 -4.009490 0.643756\n-0.455236 3.552678 -5.230236\nBr O\n2 1\ndirect\n0.328530 0.543823 0.642600 Br\n0.924009 0.296376 0.131974 Br\n-0.081567 0.014141 0.269057 O\n",
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