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{
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{
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"structure_string": "Ca4\n1.0\n-3.083911 -3.084213 0.000000\n-3.083911 3.084213 -0.000000\n0.000000 0.000000 -8.487319\nCa\n4\ndirect\n0.749986 0.250014 0.375013 Ca\n0.250014 0.749986 0.624987 Ca\n0.750013 0.249986 0.875013 Ca\n0.249986 0.750013 0.124987 Ca\n",
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{
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"structure_string": "Li8 S4\n1.0\n3.895854 0.000000 0.000000\n0.000000 6.747682 0.000000\n0.000000 0.000000 7.044216\nLi S\n8 4\ndirect\n0.723976 0.416678 0.592177 Li\n0.223976 0.916678 0.907824 Li\n0.223976 0.583322 0.407824 Li\n0.224701 0.916692 0.592207 Li\n0.224701 0.583307 0.092206 Li\n0.724700 0.416692 0.907794 Li\n0.723976 0.083322 0.092176 Li\n0.724700 0.083308 0.407794 Li\n0.224323 0.583316 0.750009 S\n0.724322 0.416683 0.249992 S\n0.724322 0.083317 0.749992 S\n0.224323 0.916683 0.250008 S\n",
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{
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"structure_string": "H8 C10 O4\n1.0\n4.434816 -0.019869 0.493257\n2.004620 5.412461 0.542151\n0.205239 0.124354 8.090762\nH C O\n8 10 4\ndirect\n0.752252 0.823122 0.365362 H\n0.133325 0.894911 0.125505 H\n0.266710 0.605124 0.374525 H\n0.647783 0.676912 0.134667 H\n0.974004 0.016628 0.783296 H\n0.911927 0.820880 0.645865 H\n0.426033 0.483401 0.716730 H\n0.488109 0.679151 0.854160 H\n0.093420 0.863922 0.703386 C\n0.306615 0.636108 0.796638 C\n0.455651 0.450814 0.318370 C\n0.944386 0.049220 0.181660 C\n0.730848 0.009455 0.314231 C\n0.157274 0.325367 0.979529 C\n0.242762 0.174667 0.520501 C\n0.484033 0.210244 0.382901 C\n0.916005 0.289791 0.117130 C\n0.669188 0.490580 0.185799 C\n0.091469 0.567896 0.929303 O\n0.387566 0.157742 0.920854 O\n0.012478 0.342290 0.579182 O\n0.308564 0.932136 0.570721 O\n",
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{
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{
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