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"structure_string": "Ba4 Tl1 Te1\n1.0\n-0.000000 5.030489 5.030489\n5.030489 -0.000000 5.030489\n5.030489 5.030489 0.000000\nBa Tl Te\n4 1 1\ndirect\n0.127783 0.624072 0.624072 Ba\n0.624072 0.624072 0.624072 Ba\n0.624072 0.127783 0.624072 Ba\n0.624072 0.624072 0.127783 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Te\n",
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"structure_string": "Li1 Cr1 O2\n1.0\n2.782144 -0.020142 4.209081\n1.250383 2.485412 4.209081\n-0.032946 -0.020142 5.045355\nLi Cr O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.499998 0.500000 0.500001 Cr\n0.241956 0.241957 0.241957 O\n0.758040 0.758044 0.758044 O\n",
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"structure_string": "K2 Be1 Si1\n1.0\n6.229902 0.000000 0.000000\n0.000000 6.229902 0.000000\n0.000000 0.000000 2.935873\nK Be Si\n2 1 1\ndirect\n0.500000 0.000000 0.000000 K\n0.000000 0.500000 0.000000 K\n0.000000 0.000000 0.499999 Be\n0.500000 0.500000 0.499999 Si\n",
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"structure_string": "Ti1 Be1 Tl1\n1.0\n-1.511463 1.511463 5.557043\n1.511463 -1.511463 5.557043\n1.511463 1.511463 -5.557043\nTi Be Tl\n1 1 1\ndirect\n0.640745 0.640745 0.000000 Ti\n0.013755 0.013755 0.000000 Be\n0.345501 0.345501 0.000000 Tl\n",
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"structure_string": "Be2 Mo1 Br1\n1.0\n3.119628 -0.000000 -0.000000\n0.000000 3.119628 -0.000000\n0.000000 0.000000 5.905366\nBe Mo Br\n2 1 1\ndirect\n0.000000 0.000000 0.010887 Be\n0.500000 0.500000 0.198156 Be\n0.500000 0.500000 0.822005 Mo\n0.000000 0.000000 0.468953 Br\n",
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"structure_string": "Hf4 Be1 Te1\n1.0\n0.000000 4.047559 4.047559\n4.047559 0.000000 4.047559\n4.047559 4.047559 0.000000\nHf Be Te\n4 1 1\ndirect\n0.120330 0.626557 0.626557 Hf\n0.626557 0.626557 0.626557 Hf\n0.626557 0.120330 0.626557 Hf\n0.626557 0.626557 0.120330 Hf\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Te\n",
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"structure_string": "Ti2 In1 Ni1\n1.0\n3.191883 3.191883 0.000000\n3.191883 0.000000 -3.191883\n0.000000 3.191883 -3.191883\nTi In Ni\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.749999 0.749999 0.749999 Ti\n0.250000 0.250000 0.250000 In\n0.500000 0.500000 0.500000 Ni\n",
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"structure_string": "Th4 Se8 O28\n1.0\n7.054938 0.014153 0.000000\n-2.038080 8.851224 0.000000\n0.000000 0.000000 9.652907\nTh Se O\n4 8 28\ndirect\n0.789971 0.132984 0.460006 Th\n0.789970 0.632983 0.039994 Th\n0.210030 0.867016 0.539994 Th\n0.210030 0.367016 0.960006 Th\n0.671966 0.248045 0.096142 Se\n0.877586 0.983260 0.819408 Se\n0.122414 0.516739 0.319408 Se\n0.671966 0.748044 0.403858 Se\n0.122414 0.016739 0.180592 Se\n0.328034 0.751955 0.903858 Se\n0.328034 0.251955 0.596142 Se\n0.877586 0.483260 0.680592 Se\n0.271941 0.646348 0.414872 O\n0.257492 0.474654 0.191258 O\n0.548528 0.889994 0.442589 O\n0.271941 0.146348 0.085128 O\n0.103644 0.124585 0.562084 O\n0.952612 0.136793 0.915250 O\n0.451472 0.110005 0.557411 O\n0.896356 0.875414 0.437917 O\n0.952612 0.636793 0.584751 O\n0.060478 0.406437 0.732448 O\n0.896356 0.375414 0.062083 O\n0.728059 0.353651 0.585129 O\n0.060478 0.906437 0.767552 O\n0.742508 0.025346 0.691259 O\n0.658716 0.245775 0.273082 O\n0.341284 0.754225 0.726919 O\n0.257492 0.974653 0.308742 O\n0.728059 0.853651 0.914872 O\n0.939522 0.093562 0.232448 O\n0.341284 0.254225 0.773082 O\n0.548528 0.389994 0.057411 O\n0.047388 0.363206 0.415250 O\n0.451472 0.610005 0.942589 O\n0.103644 0.624585 0.937917 O\n0.742508 0.525346 0.808742 O\n0.047388 0.863206 0.084750 O\n0.939522 0.593562 0.267552 O\n0.658716 0.745774 0.226918 O\n",
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