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"structure_string": "Be2 Si1 Cl1\n1.0\n3.135391 0.000000 0.000000\n0.000000 3.135391 0.000000\n0.000000 0.000000 6.219792\nBe Si Cl\n2 1 1\ndirect\n0.000000 0.000000 0.013830 Be\n0.500000 0.500000 0.228577 Be\n0.500000 0.500000 0.871423 Si\n0.000000 0.000000 0.386170 Cl\n",
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{
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"structure_string": "Li5 Fe1 S4\n1.0\n6.044598 0.022898 -4.733137\n-0.394923 3.568882 -6.785823\n-0.042223 -0.022898 7.677107\nLi Fe S\n5 1 4\ndirect\n0.394635 0.177188 0.217447 Li\n0.959742 0.177188 0.782554 Li\n0.040259 0.822811 0.217447 Li\n0.605366 0.822811 0.782554 Li\n0.500000 0.500000 0.000000 Li\n0.000000 0.499999 0.500000 Fe\n0.756543 -0.000000 0.756542 S\n0.204747 0.704746 0.500000 S\n0.795254 0.295253 0.500000 S\n0.243458 -0.000000 0.243458 S\n",
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{
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"structure_string": "Mg2 H4 C6 O8\n1.0\n4.139078 -0.034901 1.026675\n-0.538096 5.599164 2.119111\n-0.184856 -0.019100 8.124204\nMg H C O\n2 4 6 8\ndirect\n0.357997 0.115401 0.588644 Mg\n0.980406 0.400769 0.040435 Mg\n0.620862 0.652100 0.548307 H\n0.284233 0.920671 0.082112 H\n0.953259 0.498557 0.609594 H\n0.652393 0.786569 0.071159 H\n0.439483 0.812173 0.164046 C\n0.743494 0.583291 0.658069 C\n0.550627 0.953237 0.265881 C\n0.256218 0.571969 0.281730 C\n0.513871 0.398178 0.814993 C\n0.870336 0.778353 0.710067 C\n0.316278 0.259300 0.791410 O\n0.504200 0.396375 0.975448 O\n0.350936 0.445755 0.420637 O\n0.797865 -0.006971 0.648279 O\n0.823330 0.074175 0.196202 O\n0.072567 0.726663 0.811583 O\n0.364432 0.947179 0.413149 O\n0.015999 0.506338 0.235955 O\n",
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"structure_string": "Li1 Al1 O1\n1.0\n3.865261 -0.000000 -0.000000\n-1.932631 3.347415 0.000000\n0.000000 0.000000 2.891426\nLi Al O\n1 1 1\ndirect\n0.333334 0.666667 0.000000 Li\n0.000000 0.000000 0.000000 Al\n0.666667 0.333333 0.000000 O\n",
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"structure_string": "Ca2 C4\n1.0\n3.764017 0.006832 0.966895\n1.476924 3.462161 0.966895\n-0.043238 -0.028620 7.359972\nCa C\n2 4\ndirect\n0.824850 0.175151 0.249999 Ca\n0.175150 0.824848 0.749999 Ca\n0.141894 0.423071 0.439781 C\n0.576929 0.858105 0.060218 C\n0.423071 0.141894 0.939781 C\n0.858106 0.576928 0.560218 C\n",
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}