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{
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{
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{
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{
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"structure_string": "Ba12 Ta8 Ni4 O36\n1.0\n5.825416 0.000000 0.000000\n0.000000 10.089916 7.163925\n0.000000 -10.089916 7.163925\nBa Ta Ni O\n12 8 4 36\ndirect\n0.500000 0.250000 0.750000 Ba\n0.000000 0.000000 0.000000 Ba\n0.000000 0.500000 0.500000 Ba\n0.500000 0.750000 0.250000 Ba\n0.000000 0.502519 0.835852 Ba\n0.500000 0.252519 0.085852 Ba\n0.500000 0.752519 0.585852 Ba\n0.000000 0.002519 0.335852 Ba\n0.500000 0.747481 0.914148 Ba\n0.000000 0.497481 0.164148 Ba\n0.000000 0.997481 0.664148 Ba\n0.500000 0.247481 0.414148 Ba\n0.500000 0.504861 0.671528 Ta\n0.000000 0.254861 0.921528 Ta\n0.000000 0.754861 0.421528 Ta\n0.500000 0.004861 0.171528 Ta\n0.000000 0.745139 0.078472 Ta\n0.500000 0.495139 0.328472 Ta\n0.500000 0.995139 0.828472 Ta\n0.000000 0.245139 0.578472 Ta\n0.500000 0.500000 0.000000 Ni\n0.000000 0.750000 0.750000 Ni\n0.000000 0.250000 0.250000 Ni\n0.500000 0.000000 0.500000 Ni\n0.000000 0.250000 0.750000 O\n0.500000 0.000000 0.000000 O\n0.500000 0.500000 0.500000 O\n0.000000 0.750000 0.250000 O\n0.750000 0.375000 0.625000 O\n0.250000 0.125000 0.875000 O\n0.250000 0.625000 0.375000 O\n0.750000 0.875000 0.125000 O\n0.250000 0.375000 0.625000 O\n0.750000 0.125000 0.875000 O\n0.750000 0.625000 0.375000 O\n0.250000 0.875000 0.125000 O\n0.757573 0.630569 0.044711 O\n0.257573 0.380569 0.294711 O\n0.257573 0.880569 0.794711 O\n0.757573 0.130569 0.544711 O\n0.242426 0.630569 0.044711 O\n0.742426 0.380569 0.294711 O\n0.742426 0.880569 0.794711 O\n0.242426 0.130569 0.544711 O\n0.000000 0.751782 0.923498 O\n0.500000 0.501782 0.173498 O\n0.500000 0.001782 0.673498 O\n0.000000 0.251782 0.423498 O\n0.257572 0.619431 0.705289 O\n0.757572 0.369431 0.955289 O\n0.757572 0.869431 0.455289 O\n0.257572 0.119431 0.205289 O\n0.742428 0.619431 0.705289 O\n0.242428 0.369431 0.955289 O\n0.242428 0.869431 0.455289 O\n0.742428 0.119431 0.205289 O\n0.500000 0.498218 0.826503 O\n0.000000 0.248218 0.076503 O\n0.000000 0.748218 0.576503 O\n0.500000 0.998218 0.326503 O\n",
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{
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{
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