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"structure_string": "In2 Cu1 Se4\n1.0\n5.671724 0.000000 -0.000000\n-0.000000 5.671724 -0.000000\n-2.835862 -2.835862 5.767701\nIn Cu Se\n2 1 4\ndirect\n0.500000 0.500000 0.000000 In\n0.750000 0.250000 0.500000 In\n0.000000 0.000000 0.000000 Cu\n0.604233 0.071628 0.737020 Se\n0.132789 0.665392 0.737020 Se\n0.928371 0.867211 0.262979 Se\n0.334607 0.395767 0.262979 Se\n",
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"structure_string": "Ca1 Ni5 H1\n1.0\n0.000004 0.002615 3.974226\n2.533333 4.262487 0.081681\n-2.533045 4.262593 0.081673\nCa Ni H\n1 5 1\ndirect\n0.978444 0.996084 0.996113 Ca\n0.011287 0.340312 0.340337 Ni\n0.009046 0.661090 0.661122 Ni\n0.512941 0.500500 0.500530 Ni\n0.516569 0.991246 0.512521 Ni\n0.516569 0.512492 0.991274 Ni\n0.309040 0.202172 0.202203 H\n",
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