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"structure_string": "Al3 Ga1 N4\n1.0\n3.142457 -0.000000 0.000000\n0.000000 5.076982 0.003533\n-0.000000 0.000569 5.441084\nAl Ga N\n3 1 4\ndirect\n0.500000 0.499894 0.832617 Al\n0.500000 0.000500 0.164917 Al\n-0.000000 0.000793 0.668581 Al\n-0.000000 0.499163 0.333865 Ga\n-0.000000 0.109690 0.333747 N\n0.500000 0.123138 0.832829 N\n0.500000 0.626359 0.158220 N\n-0.000000 0.624064 0.675219 N\n",
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"structure_string": "H4 C7 S1 O2\n1.0\n3.773501 0.015327 0.007613\n0.232312 5.338031 0.004837\n-0.011175 -0.004349 7.541055\nH C S O\n4 7 1 2\ndirect\n0.728083 0.855339 0.405520 H\n0.194408 0.163971 0.741742 H\n0.193928 0.163792 0.405046 H\n0.728545 0.855514 0.739950 H\n0.299804 0.316477 0.481130 C\n0.300054 0.316577 0.665374 C\n0.459425 0.509348 0.391770 C\n0.459896 0.509546 0.754356 C\n0.599614 0.710803 0.480117 C\n0.599870 0.710898 0.665650 C\n0.412613 0.598969 0.073053 C\n0.185929 0.867584 0.073059 S\n0.528527 0.459529 0.212263 O\n0.529513 0.459922 0.933833 O\n",
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"structure_string": "Co3 Re1 B4\n1.0\n3.033952 -0.000000 0.000000\n0.000000 4.103672 0.098894\n0.000000 -0.004848 5.465341\nCo Re B\n3 1 4\ndirect\n-0.000000 0.872047 0.827219 Co\n0.500000 0.374467 0.681496 Co\n0.500000 0.123631 0.170972 Co\n-0.000000 0.627665 0.320785 Re\n-0.000000 0.127171 0.481023 B\n-0.000000 0.367712 0.956116 B\n0.500000 0.901444 0.547382 B\n0.500000 0.605860 0.015002 B\n",
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"structure_string": "Mn4 As1 P3\n1.0\n3.256127 0.000000 0.000000\n0.000000 5.285869 0.000369\n0.000000 0.000203 5.902657\nMn As P\n4 1 3\ndirect\n0.500000 0.501081 0.307110 Mn\n0.500000 0.008423 0.205041 Mn\n-0.000000 0.490194 0.686380 Mn\n-0.000000 0.008655 0.798989 Mn\n0.500000 0.693278 0.924341 As\n0.500000 0.193434 0.573137 P\n-0.000000 0.300880 0.079002 P\n-0.000000 0.804053 0.426002 P\n",
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{
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}