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{
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{
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{
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"structure_string": "Li4 Fe3 Co3 Sn2 O16\n1.0\n2.986491 5.139622 0.000000\n-2.986491 5.139622 0.000000\n0.000000 0.114426 9.789891\nLi Fe Co Sn O\n4 3 3 2 16\ndirect\n0.664954 0.664954 0.105009 Li\n0.002979 0.002979 0.005100 Li\n0.002275 0.002275 0.506474 Li\n0.331655 0.331655 0.606225 Li\n0.830779 0.830779 0.786431 Fe\n0.170328 0.661901 0.285641 Fe\n0.661901 0.170328 0.285641 Fe\n0.338726 0.832810 0.785602 Co\n0.832810 0.338726 0.785602 Co\n0.169932 0.169932 0.285802 Co\n0.666093 0.666093 0.510152 Sn\n0.333513 0.333513 0.009897 Sn\n0.323554 0.840871 0.399573 O\n0.516116 0.516116 0.663412 O\n0.661374 0.661374 0.891427 O\n0.003597 0.003597 0.693360 O\n0.004430 0.004430 0.192042 O\n0.840871 0.323554 0.399573 O\n0.511342 0.964881 0.662264 O\n0.964881 0.511342 0.662264 O\n0.162849 0.162849 0.895899 O\n0.839544 0.839544 0.401862 O\n0.033370 0.477855 0.161031 O\n0.477855 0.033370 0.161031 O\n0.329884 0.329884 0.393262 O\n0.162922 0.678666 0.899619 O\n0.482663 0.482663 0.159183 O\n0.678666 0.162922 0.899619 O\n",
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{
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"structure_string": "Ca12 Y4 Al12 B16 O60\n1.0\n11.689924 0.000000 0.000000\n0.000000 10.526508 0.000000\n0.000000 5.262699 9.117932\nCa Y Al B O\n12 4 12 16 60\ndirect\n0.000000 0.874542 0.823630 Ca\n0.500000 0.672994 0.658930 Ca\n0.500000 0.838449 0.310091 Ca\n0.000000 0.838023 0.306284 Ca\n0.750633 0.749245 0.118513 Ca\n0.249367 0.749245 0.118513 Ca\n0.500000 0.328947 0.853390 Ca\n0.000000 0.325359 0.858954 Ca\n0.750797 0.164570 0.725838 Ca\n0.249203 0.164570 0.725838 Ca\n0.749503 0.135714 0.136954 Ca\n0.250497 0.135714 0.136954 Ca\n0.500000 0.870477 0.816086 Y\n0.000000 0.677237 0.662627 Y\n0.749789 0.343277 0.328445 Y\n0.250211 0.343277 0.328445 Y\n0.627180 0.513946 0.995694 Al\n0.126459 0.515087 0.996042 Al\n0.374359 0.509549 0.494442 Al\n0.873776 0.508098 0.497097 Al\n0.625641 0.509549 0.494442 Al\n0.126224 0.508098 0.497097 Al\n0.372820 0.513946 0.995694 Al\n0.873541 0.515087 0.996042 Al\n0.873670 0.009098 0.493883 Al\n0.371060 0.007692 0.491953 Al\n0.628940 0.007692 0.491953 Al\n0.126330 0.009098 0.493883 Al\n0.374109 0.012722 0.993651 B\n0.752647 0.783693 0.764671 B\n0.247353 0.783693 0.764671 B\n0.625891 0.012722 0.993651 B\n0.869478 0.015523 0.993393 B\n0.130522 0.015523 0.993393 B\n0.249349 0.775521 0.453741 B\n0.750651 0.775521 0.453741 B\n0.750070 0.476320 0.766509 B\n0.249930 0.476320 0.766509 B\n0.500000 0.554724 0.219182 B\n0.000000 0.554801 0.220415 B\n0.500000 0.240782 0.540397 B\n0.000000 0.239863 0.540203 B\n0.500000 0.235462 0.226158 B\n0.000000 0.233828 0.225510 B\n0.650291 0.839943 0.690845 O\n0.145311 0.834453 0.688617 O\n0.854689 0.834453 0.688617 O\n0.349709 0.839943 0.690845 O\n0.500000 0.919031 0.475923 O\n0.000000 0.915515 0.474930 O\n0.249833 0.923326 0.421666 O\n0.750167 0.923326 0.421666 O\n0.751454 0.674330 0.913750 O\n0.248546 0.674330 0.913750 O\n0.500000 0.630063 0.906213 O\n0.000000 0.627178 0.903562 O\n0.853829 0.702376 0.475364 O\n0.351144 0.703404 0.468438 O\n0.648856 0.703404 0.468438 O\n0.146171 0.702376 0.475364 O\n0.853131 0.500197 0.817696 O\n0.648476 0.495387 0.822230 O\n0.351524 0.495387 0.822230 O\n0.146869 0.500197 0.817696 O\n0.500000 0.484268 0.607335 O\n0.000000 0.487288 0.610673 O\n0.500000 0.587978 0.332661 O\n0.000000 0.585811 0.335752 O\n0.750113 0.437091 0.655978 O\n0.249887 0.437091 0.655978 O\n0.750642 0.531882 0.377873 O\n0.249358 0.531882 0.377873 O\n0.136912 0.165745 0.928886 O\n0.633344 0.162225 0.919226 O\n0.863088 0.165745 0.928886 O\n0.366656 0.162225 0.919226 O\n0.604402 0.538607 0.164922 O\n0.104052 0.539852 0.165018 O\n0.395598 0.538607 0.164922 O\n0.895948 0.539852 0.165018 O\n0.604074 0.312100 0.520371 O\n0.395926 0.312100 0.520371 O\n0.103789 0.311372 0.524341 O\n0.896211 0.311372 0.524341 O\n0.371308 0.937862 0.916308 O\n0.628692 0.937862 0.916308 O\n0.861259 0.951119 0.907716 O\n0.138741 0.951119 0.907716 O\n0.249361 0.393589 0.087983 O\n0.750639 0.393589 0.087983 O\n0.500000 0.351618 0.079366 O\n0.000000 0.351241 0.079735 O\n0.500000 0.090569 0.580731 O\n0.000000 0.093325 0.571217 O\n0.750611 0.103485 0.519057 O\n0.249389 0.103485 0.519057 O\n0.896082 0.177391 0.296535 O\n0.395971 0.179705 0.297259 O\n0.604029 0.179705 0.297259 O\n0.103918 0.177391 0.296535 O\n0.864563 0.930040 0.143549 O\n0.365582 0.933778 0.143571 O\n0.634418 0.933778 0.143571 O\n0.135437 0.930040 0.143549 O\n",
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{
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{
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