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"structure_string": "Ba1 Ca1 I4\n1.0\n5.637281 0.000000 0.000000\n-0.000000 5.637281 -0.000000\n-0.000000 -0.000000 8.086781\nBa Ca I\n1 1 4\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.500000 Ca\n0.000000 0.500000 0.264694 I\n0.500000 0.000000 0.264694 I\n0.000000 0.500000 0.735306 I\n0.500000 0.000000 0.735306 I\n",
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"structure_string": "Ba4 Tl1 Bi1\n1.0\n0.000000 5.046004 5.046004\n5.046004 0.000000 5.046004\n5.046004 5.046004 0.000000\nBa Tl Bi\n4 1 1\ndirect\n0.127874 0.624042 0.624042 Ba\n0.624042 0.624042 0.624042 Ba\n0.624042 0.127874 0.624042 Ba\n0.624042 0.624042 0.127874 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Bi\n",
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"structure_string": "K2 Sr2 I6\n1.0\n7.981613 0.013254 0.000000\n-6.604730 4.481502 0.000000\n-0.000000 0.000000 11.943326\nK Sr I\n2 2 6\ndirect\n0.248870 0.751129 0.250000 K\n0.751129 0.248869 0.750000 K\n0.000000 0.000000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.641739 0.358259 0.063328 I\n0.358259 0.641739 0.936672 I\n0.358259 0.641739 0.563328 I\n0.641739 0.358259 0.436672 I\n0.917723 0.082275 0.250000 I\n0.082276 0.917723 0.750000 I\n",
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"structure_string": "Ba1 Mg1 Se1\n1.0\n3.767202 0.000000 0.000000\n0.000000 3.767202 -0.000000\n0.000000 -0.000000 9.052313\nBa Mg Se\n1 1 1\ndirect\n0.000000 0.000000 0.317888 Ba\n0.000000 0.000000 0.720985 Mg\n0.000000 0.000000 -0.006976 Se\n",
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"structure_string": "Sr4 Ca2 I12\n1.0\n8.410366 -0.013638 0.447800\n-4.471051 7.123493 0.447800\n-0.156929 -0.283233 12.843150\nSr Ca I\n4 2 12\ndirect\n0.295629 0.583673 0.575256 Sr\n0.416328 0.704371 0.924744 Sr\n0.583673 0.295629 0.075256 Sr\n0.704371 0.416327 0.424744 Sr\n-0.013760 0.013760 0.250000 Ca\n0.013760 -0.013759 0.750000 Ca\n0.986835 0.257095 0.432591 I\n0.742905 0.013166 0.067409 I\n0.621415 0.933026 0.694658 I\n0.411396 0.276501 0.628966 I\n0.588605 0.723499 0.371034 I\n0.013166 0.742904 0.567409 I\n0.257096 0.986834 0.932591 I\n0.066974 0.378585 0.805342 I\n0.933027 0.621414 0.194658 I\n0.276501 0.411395 0.128966 I\n0.378585 0.066973 0.305342 I\n0.723500 0.588605 0.871034 I\n",
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"structure_string": "Rb1 Bi1 S1\n1.0\n3.818833 -0.000000 -0.000000\n-0.000000 3.818833 0.000000\n-0.000000 -0.000000 8.808868\nRb Bi S\n1 1 1\ndirect\n0.000000 0.000000 0.670645 Rb\n0.000000 0.000000 0.271873 Bi\n0.000000 0.000000 0.001379 S\n",
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{
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"structure_string": "Pb2 I4\n1.0\n4.536984 0.007465 13.629727\n2.215097 3.959499 13.629727\n0.012707 0.007465 14.365011\nPb I\n2 4\ndirect\n0.000000 0.000000 0.000000 Pb\n0.500000 0.500001 0.499999 Pb\n0.121877 0.121877 0.121877 I\n0.878122 0.878125 0.878122 I\n0.288544 0.288545 0.288544 I\n0.711455 0.711458 0.711455 I\n",
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{
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