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{
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{
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"structure_string": "Ba1 I2\n1.0\n6.251025 -0.000000 -0.000000\n-3.125512 5.413546 0.000000\n0.000000 -0.000000 5.300897\nBa I\n1 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666667 0.000000 I\n0.666666 0.333334 0.000000 I\n",
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"structure_string": "Ba1 I1\n1.0\n5.922878 -0.000000 0.000000\n-2.961439 5.129362 -0.000000\n-0.000000 0.000000 4.429938\nBa I\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333333 0.666666 0.000000 I\n",
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{
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