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"structure_string": "Ti4 Ge4 S12\n1.0\n3.491169 -0.000000 0.000000\n0.000000 9.029578 0.000000\n-0.000000 -0.000000 13.261621\nTi Ge S\n4 4 12\ndirect\n0.750000 0.346551 0.954294 Ti\n0.750000 0.846551 0.545706 Ti\n0.250000 0.653449 0.045706 Ti\n0.250000 0.153449 0.454294 Ti\n0.250000 0.068069 0.839705 Ge\n0.250000 0.568069 0.660295 Ge\n0.750000 0.931932 0.160295 Ge\n0.750000 0.431932 0.339705 Ge\n0.250000 0.678047 0.487887 S\n0.250000 0.178047 0.012113 S\n0.250000 0.264405 0.286168 S\n0.250000 0.764405 0.213832 S\n0.750000 0.735596 0.713832 S\n0.250000 0.013350 0.609198 S\n0.750000 0.986650 0.390802 S\n0.750000 0.486650 0.109198 S\n0.750000 0.821953 0.987887 S\n0.250000 0.513351 0.890802 S\n0.750000 0.235596 0.786168 S\n0.750000 0.321953 0.512113 S\n",
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"structure_string": "Zr2 As3 Se1\n1.0\n3.833027 -0.000000 0.000000\n0.000000 3.833027 0.000000\n-0.000000 -0.000000 8.117909\nZr As Se\n2 3 1\ndirect\n0.500000 0.500000 0.735204 Zr\n0.000000 0.000000 0.266689 Zr\n0.500000 0.000000 0.999303 As\n-0.000000 0.500000 0.999303 As\n0.500000 0.500000 0.378122 As\n0.000000 0.000000 0.621383 Se\n",
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