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{
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{
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{
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{
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{
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"structure_string": "Ba8 P5 Br1\n1.0\n-4.971304 4.971304 4.947671\n4.971304 -4.971304 4.947671\n4.971304 4.971304 -4.947671\nBa P Br\n8 5 1\ndirect\n0.735362 0.366634 0.243950 Ba\n0.985752 0.740003 0.098689 Ba\n0.641315 0.887063 0.901311 Ba\n0.122684 0.491412 0.756050 Ba\n0.633366 0.877316 0.368729 Ba\n0.508588 0.264638 0.631271 Ba\n0.259997 0.358685 0.245748 Ba\n0.112937 0.014248 0.754252 Ba\n0.747874 0.632249 0.626332 P\n0.367751 0.994083 0.115625 P\n0.005917 0.121542 0.373668 P\n0.500000 0.500000 0.000000 P\n0.878458 0.252126 0.884375 P\n0.250000 0.750000 0.500000 Br\n",
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{
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{
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