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{
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{
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"structure_string": "Th8 Se12\n1.0\n11.405931 0.000000 0.000000\n0.000000 4.076032 0.000000\n0.000000 0.000000 11.356959\nTh Se\n8 12\ndirect\n0.479610 0.250000 0.185091 Th\n0.979610 0.250000 0.314909 Th\n0.520390 0.750000 0.814909 Th\n0.020390 0.750000 0.685091 Th\n0.699364 0.750000 0.486414 Th\n0.199364 0.750000 0.013586 Th\n0.300636 0.250000 0.513586 Th\n0.800636 0.250000 0.986414 Th\n0.551083 0.250000 0.620947 Se\n0.051083 0.250000 0.879053 Se\n0.448917 0.750000 0.379053 Se\n0.948917 0.750000 0.120947 Se\n0.623016 0.750000 0.056556 Se\n0.123016 0.750000 0.443444 Se\n0.376984 0.250000 0.943444 Se\n0.876984 0.250000 0.556556 Se\n0.720299 0.250000 0.293129 Se\n0.220299 0.250000 0.206871 Se\n0.279701 0.750000 0.706871 Se\n0.779701 0.750000 0.793129 Se\n",
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{
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{
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"structure_string": "Ba8 Ge16\n1.0\n6.877045 0.000000 0.000000\n0.000000 9.269929 0.000000\n0.000000 0.000000 11.729169\nBa Ge\n8 16\ndirect\n0.250000 0.847479 0.906709 Ba\n0.750000 0.152521 0.093291 Ba\n0.250000 0.347479 0.593291 Ba\n0.750000 0.652521 0.406709 Ba\n0.250000 0.014300 0.309398 Ba\n0.750000 0.985700 0.690602 Ba\n0.250000 0.514300 0.190602 Ba\n0.750000 0.485700 0.809398 Ba\n0.562521 0.808024 0.149691 Ge\n0.062521 0.191976 0.850309 Ge\n0.937479 0.308024 0.350309 Ge\n0.437479 0.691976 0.649691 Ge\n0.437479 0.191976 0.850309 Ge\n0.937479 0.808024 0.149691 Ge\n0.062521 0.691976 0.649691 Ge\n0.562521 0.308024 0.350309 Ge\n0.750000 0.076889 0.407155 Ge\n0.250000 0.923111 0.592845 Ge\n0.750000 0.576889 0.092845 Ge\n0.250000 0.423111 0.907155 Ge\n0.750000 0.304893 0.540671 Ge\n0.250000 0.695107 0.459329 Ge\n0.750000 0.804893 0.959329 Ge\n0.250000 0.195107 0.040671 Ge\n",
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