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"structure_string": "Li2 Co3 Ni1 O8\n1.0\n-2.830710 1.634311 4.622529\n-0.000000 3.268622 -4.622529\n-2.848159 -1.644386 -4.629654\nLi Co Ni O\n2 3 1 8\ndirect\n0.873420 0.126579 0.620260 Li\n0.126580 0.873419 0.379740 Li\n0.500000 0.500000 0.000000 Co\n0.500000 -0.000000 -0.000000 Co\n-0.000000 0.500000 0.000000 Co\n0.500000 0.499999 0.500000 Ni\n0.736989 0.709473 0.764505 O\n0.736989 0.263009 0.764505 O\n0.264134 0.735865 0.792401 O\n0.290525 0.263009 0.764505 O\n0.709474 0.736989 0.235496 O\n0.735866 0.264133 0.207600 O\n0.263010 0.736989 0.235496 O\n0.263010 0.290525 0.235496 O\n",
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"structure_string": "Lu2 Ta2 O8\n1.0\n4.718047 0.005509 -1.785153\n-1.255547 4.694749 -1.953529\n-0.011514 0.004097 6.421763\nLu Ta O\n2 2 8\ndirect\n0.381118 0.631118 0.262236 Lu\n0.618883 0.368883 0.737765 Lu\n0.853934 0.103934 0.207869 Ta\n0.146067 0.896067 0.792132 Ta\n0.003587 0.782900 0.062114 O\n0.558527 0.279216 0.062114 O\n0.996414 0.217101 0.937887 O\n0.441474 0.720786 0.937886 O\n0.215048 0.375897 0.425509 O\n0.710462 0.049613 0.425509 O\n0.784953 0.624104 0.574491 O\n0.289539 0.950388 0.574491 O\n",
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"structure_string": "Ca1 N2\n1.0\n3.769583 0.551402 0.983012\n-0.188908 -3.868471 0.342514\n-1.111607 1.413467 -3.087738\nCa N\n1 2\ndirect\n0.096359 0.075316 0.095504 Ca\n0.490484 0.680377 0.095598 N\n0.702262 0.470260 0.095379 N\n",
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"structure_string": "Sm1 Si2 Rh2\n1.0\n3.837890 0.000000 -1.438192\n-0.538941 3.799861 -1.438192\n-0.008295 -0.009554 5.817765\nSm Si Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.623273 0.623272 0.246546 Si\n0.376729 0.376729 0.753456 Si\n0.250001 0.750000 0.500001 Rh\n0.750001 0.250000 0.500001 Rh\n",
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"structure_string": "Hf2 Cr2 Cu2 S8\n1.0\n6.236140 0.011289 -3.524390\n-2.102886 5.866814 -3.531184\n-0.024748 -0.011289 7.163110\nHf Cr Cu S\n2 2 2 8\ndirect\n0.249951 0.750000 -0.000048 Hf\n0.250048 0.250000 0.500048 Hf\n0.249999 0.750006 0.500006 Cr\n0.749999 0.749993 -0.000006 Cr\n0.880855 0.130855 0.750000 Cu\n0.619145 0.369145 0.250000 Cu\n0.501309 0.979498 0.978200 S\n0.010639 0.507904 0.502684 S\n0.501297 0.523109 0.521799 S\n0.505219 0.507955 0.997315 S\n0.998702 0.520501 0.021811 S\n0.994779 0.992095 0.002736 S\n0.998689 0.976890 0.478188 S\n0.489360 -0.007956 0.497264 S\n",
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"structure_string": "V3 Te4\n1.0\n-0.000000 3.961116 -0.000000\n0.027165 -0.000000 6.889672\n6.208270 -1.980558 -3.283276\nV Te\n3 4\ndirect\n0.000000 0.000000 0.000000 V\n0.743921 0.709350 0.487840 V\n0.256079 0.290649 0.512159 V\n0.635310 0.974047 0.270620 Te\n0.364690 0.025952 0.729379 Te\n0.887857 0.547801 0.775715 Te\n0.112143 0.452197 0.224285 Te\n",
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"structure_string": "V3 Te4\n1.0\n3.830270 -0.000000 -1.009252\n-0.792305 6.148003 -3.006920\n-0.125902 -0.100114 7.295041\nV Te\n3 4\ndirect\n0.256080 0.290654 0.512160 V\n0.743920 0.709347 0.487840 V\n0.000000 0.000000 0.000000 V\n0.635304 0.974030 0.270611 Te\n0.364696 0.025970 0.729390 Te\n0.112132 0.452187 0.224265 Te\n0.887867 0.547813 0.775735 Te\n",
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"structure_string": "Mg2 H12 N4 Cl4\n1.0\n-4.060868 4.048053 3.746728\n4.060868 -4.048053 3.746728\n4.060868 4.048053 -3.746728\nMg H N Cl\n2 12 4 4\ndirect\n0.750000 0.745123 0.995122 Mg\n0.250000 0.254878 0.004878 Mg\n0.670116 0.437927 0.390543 H\n0.952617 0.562074 0.232189 H\n0.170117 0.779573 0.232190 H\n0.329884 0.562074 0.609457 H\n0.047383 0.437927 0.767811 H\n0.452617 0.220428 0.390543 H\n0.547383 0.779573 0.609457 H\n0.073243 0.847118 0.420360 H\n0.573242 0.152883 0.226124 H\n0.926757 0.152883 0.579640 H\n0.426758 0.847118 0.773875 H\n0.829883 0.220428 0.767810 H\n0.483880 0.734005 0.717884 N\n0.983880 0.265997 0.749875 N\n0.516119 0.265997 0.282116 N\n0.016120 0.734005 0.250125 N\n0.991615 0.207698 0.216082 Cl\n0.491615 0.275533 0.783917 Cl\n0.508385 0.724467 0.216083 Cl\n0.008385 0.792302 0.783917 Cl\n",
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}