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{
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"formula_full": "Nb12 Al12 O48",
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{
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"structure_string": "Pu2 Te1 O2\n1.0\n-1.992272 1.992272 6.273179\n1.992272 -1.992272 6.273179\n1.992272 1.992272 -6.273179\nPu Te O\n2 1 2\ndirect\n0.342235 0.342235 0.000000 Pu\n0.657765 0.657765 0.000000 Pu\n0.000000 0.000000 0.000000 Te\n0.750000 0.250000 0.500000 O\n0.250000 0.750000 0.500000 O\n",
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{
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{
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"structure_string": "V8 Co4 H16 C16 N8 O24\n1.0\n7.638644 0.000000 0.000000\n0.000000 10.506233 0.000000\n0.000000 0.000000 11.699940\nV Co H C N O\n8 4 16 16 8 24\ndirect\n0.404232 0.772071 0.352159 V\n0.095768 0.727929 0.852159 V\n0.095768 0.772071 0.147841 V\n0.904232 0.227929 0.852159 V\n0.404232 0.727929 0.647841 V\n0.904232 0.272071 0.147841 V\n0.595768 0.227929 0.647841 V\n0.595768 0.272071 0.352159 V\n0.750000 0.567117 0.250000 Co\n0.750000 0.932883 0.750000 Co\n0.250000 0.067117 0.250000 Co\n0.250000 0.432883 0.750000 Co\n0.281612 0.106766 0.509287 H\n0.373804 0.466263 0.187844 H\n0.781612 0.606766 0.990713 H\n0.126196 0.466263 0.312156 H\n0.626196 0.533737 0.812156 H\n0.373804 0.033737 0.812156 H\n0.873804 0.966263 0.312156 H\n0.281612 0.393234 0.490713 H\n0.626196 0.966263 0.187844 H\n0.218388 0.106766 0.990713 H\n0.873804 0.533737 0.687844 H\n0.718388 0.893234 0.490713 H\n0.218388 0.393234 0.009287 H\n0.126196 0.033737 0.687844 H\n0.781612 0.893234 0.009287 H\n0.718388 0.606766 0.509287 H\n0.655273 0.940851 0.005124 C\n0.429824 0.482028 0.103678 C\n0.344727 0.059149 0.994876 C\n0.570176 0.517972 0.896322 C\n0.429824 0.017972 0.896322 C\n0.344727 0.440851 0.005124 C\n0.155273 0.440851 0.494876 C\n0.655273 0.559149 0.994876 C\n0.070176 0.482028 0.396322 C\n0.929824 0.517972 0.603678 C\n0.570176 0.982028 0.103678 C\n0.929824 0.982028 0.396322 C\n0.070176 0.017972 0.603678 C\n0.844727 0.559149 0.505124 C\n0.155273 0.059149 0.505124 C\n0.844727 0.940851 0.494876 C\n0.414278 0.458786 0.901029 N\n0.085722 0.041214 0.401029 N\n0.914278 0.541214 0.401029 N\n0.585722 0.958786 0.901029 N\n0.585722 0.541214 0.098971 N\n0.414278 0.041214 0.098971 N\n0.914278 0.958786 0.598971 N\n0.085722 0.458786 0.598971 N\n0.910901 0.429729 0.174163 O\n0.250000 0.704999 0.250000 O\n0.750000 0.295001 0.750000 O\n0.603111 0.792645 0.670692 O\n0.664260 0.250000 0.500000 O\n0.164260 0.750000 0.000000 O\n0.410901 0.929729 0.325837 O\n0.835740 0.250000 0.000000 O\n0.603111 0.707355 0.329308 O\n0.250000 0.795001 0.750000 O\n0.396889 0.292645 0.670692 O\n0.589099 0.429729 0.325837 O\n0.410901 0.570271 0.674163 O\n0.896889 0.707355 0.170692 O\n0.089099 0.929729 0.174163 O\n0.396889 0.207355 0.329308 O\n0.910901 0.070271 0.825837 O\n0.103111 0.292645 0.829308 O\n0.750000 0.204999 0.250000 O\n0.896889 0.792645 0.829308 O\n0.089099 0.570271 0.825837 O\n0.589099 0.070271 0.674163 O\n0.103111 0.207355 0.170692 O\n0.335740 0.750000 0.500000 O\n",
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"formula_full": "V8 Co4 H16 C16 N8 O24",
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{
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"structure_string": "Li4 Ti2 Te2 O12\n1.0\n4.991119 0.000000 0.000000\n0.000000 5.138877 0.000000\n0.000000 0.000000 8.496212\nLi Ti Te O\n4 2 2 12\ndirect\n0.000000 0.000000 0.302418 Li\n0.500000 0.000000 0.178345 Li\n0.000000 0.500000 0.678345 Li\n0.500000 0.500000 0.802418 Li\n0.000000 0.000000 0.891282 Ti\n0.500000 0.500000 0.391282 Ti\n0.500000 0.000000 0.586391 Te\n0.000000 0.500000 0.086391 Te\n0.257082 0.146567 0.743835 O\n0.297445 0.174748 0.416633 O\n0.198944 0.179302 0.075045 O\n0.698944 0.320698 0.575045 O\n0.797445 0.325252 0.916633 O\n0.757082 0.353433 0.243835 O\n0.242918 0.646567 0.243835 O\n0.202555 0.674748 0.916633 O\n0.301056 0.679302 0.575045 O\n0.801056 0.820698 0.075045 O\n0.702555 0.825252 0.416633 O\n0.742918 0.853433 0.743835 O\n",
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{
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"structure_string": "Eu8 Ge8 Se20\n1.0\n12.335428 0.000000 0.000000\n0.000000 8.514839 0.000000\n0.000000 7.802282 9.180885\nEu Ge Se\n8 8 20\ndirect\n0.337653 0.014221 0.529145 Eu\n0.837653 0.985779 0.970855 Eu\n0.196009 0.535844 0.520962 Eu\n0.662347 0.985779 0.470855 Eu\n0.696009 0.464156 0.979038 Eu\n0.162347 0.014221 0.029145 Eu\n0.803991 0.464156 0.479038 Eu\n0.303991 0.535844 0.020962 Eu\n0.480439 0.485560 0.313873 Ge\n0.550164 0.844381 0.165403 Ge\n0.519561 0.514440 0.686127 Ge\n0.980438 0.514440 0.186127 Ge\n0.949836 0.844381 0.665403 Ge\n0.449836 0.155619 0.834597 Ge\n0.050164 0.155619 0.334597 Ge\n0.019561 0.485560 0.813873 Ge\n0.493045 0.683917 0.785140 Se\n0.094477 0.101632 0.559199 Se\n0.006955 0.683917 0.285140 Se\n0.209896 0.060348 0.277196 Se\n0.560569 0.245228 0.547349 Se\n0.283528 0.517179 0.293300 Se\n0.709896 0.939652 0.222804 Se\n0.939431 0.245228 0.047349 Se\n0.060569 0.754772 0.952651 Se\n0.405523 0.101632 0.059199 Se\n0.790104 0.939652 0.722804 Se\n0.716472 0.482821 0.706700 Se\n0.216472 0.517179 0.793300 Se\n0.290104 0.060348 0.777196 Se\n0.905523 0.898368 0.440801 Se\n0.783528 0.482821 0.206700 Se\n0.993045 0.316083 0.714860 Se\n0.439431 0.754772 0.452651 Se\n0.506955 0.316083 0.214860 Se\n0.594477 0.898368 0.940801 Se\n",
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{
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{
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}