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{
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"structure_string": "Ba12 Y4 Ga8 O30\n1.0\n6.040619 0.000000 0.000000\n0.000000 8.071109 0.000000\n0.000000 0.412853 18.646241\nBa Y Ga O\n12 4 8 30\ndirect\n0.756605 0.498675 0.078616 Ba\n0.243395 0.501325 0.921384 Ba\n0.756605 0.501325 0.421384 Ba\n0.243395 0.498675 0.578616 Ba\n0.744419 0.971719 0.089822 Ba\n0.255581 0.028281 0.910178 Ba\n0.744419 0.028281 0.410178 Ba\n0.255581 0.971719 0.589822 Ba\n0.723332 0.000000 0.750000 Ba\n0.276668 0.000000 0.250000 Ba\n0.666833 0.500000 0.750000 Ba\n0.333167 0.500000 0.250000 Ba\n0.745446 0.751844 0.909877 Y\n0.254554 0.248156 0.090123 Y\n0.745446 0.248156 0.590123 Y\n0.254554 0.751844 0.409877 Y\n0.751278 0.754157 0.558652 Ga\n0.248722 0.245843 0.441348 Ga\n0.751278 0.245843 0.941348 Ga\n0.248722 0.754157 0.058652 Ga\n0.775340 0.770458 0.266178 Ga\n0.224660 0.229542 0.733822 Ga\n0.775340 0.229542 0.233822 Ga\n0.224660 0.770458 0.766178 Ga\n0.206292 0.000000 0.750000 O\n0.793708 0.000000 0.250000 O\n0.503436 0.765413 0.000355 O\n0.496564 0.234587 0.999645 O\n0.503436 0.234587 0.499645 O\n0.496564 0.765413 0.500355 O\n0.761478 0.953479 0.608735 O\n0.238522 0.046521 0.391265 O\n0.761478 0.046521 0.891265 O\n0.238522 0.953479 0.108735 O\n0.004305 0.763786 0.995085 O\n0.995695 0.236214 0.004915 O\n0.004305 0.236214 0.504915 O\n0.995695 0.763786 0.495085 O\n0.326143 0.688795 0.681483 O\n0.673857 0.311205 0.318517 O\n0.326143 0.311205 0.818517 O\n0.673857 0.688795 0.181483 O\n0.450225 0.748484 0.835752 O\n0.549775 0.251516 0.164248 O\n0.450225 0.251516 0.664248 O\n0.549775 0.748484 0.335752 O\n0.955483 0.725676 0.809520 O\n0.044517 0.274324 0.190480 O\n0.955483 0.274324 0.690480 O\n0.044517 0.725676 0.309520 O\n0.756254 0.533314 0.592140 O\n0.243746 0.466686 0.407860 O\n0.756254 0.466686 0.907860 O\n0.243746 0.533314 0.092140 O\n",
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{
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"structure_string": "Li4 Ca6 N12\n1.0\n4.036527 -7.111053 0.000000\n4.036527 7.111053 0.000000\n0.000000 0.000000 4.859586\nLi Ca N\n4 6 12\ndirect\n0.339328 0.660672 0.500000 Li\n0.339328 0.660672 0.000000 Li\n0.660672 0.339328 0.500000 Li\n0.660672 0.339328 0.000000 Li\n0.318378 0.318378 0.750000 Ca\n0.681622 0.681622 0.250000 Ca\n0.003341 0.678646 0.750000 Ca\n0.321354 0.996659 0.250000 Ca\n0.996659 0.321354 0.250000 Ca\n0.678646 0.003341 0.750000 Ca\n0.461100 0.113706 0.750000 N\n0.886294 0.538900 0.250000 N\n0.538900 0.886294 0.250000 N\n0.113706 0.461100 0.750000 N\n0.931557 0.334828 0.750000 N\n0.665172 0.068443 0.250000 N\n0.068443 0.665172 0.250000 N\n0.334828 0.931557 0.750000 N\n0.657991 0.565350 0.750000 N\n0.434650 0.342009 0.250000 N\n0.342009 0.434650 0.250000 N\n0.565350 0.657991 0.750000 N\n",
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{
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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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{
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{
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}