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{
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{
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{
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"structure_string": "K4 Mn4 F12\n1.0\n6.011605 0.000000 0.000000\n0.000000 6.022303 0.000000\n0.000000 0.000000 8.497305\nK Mn F\n4 4 12\ndirect\n0.507114 0.510757 0.250000 K\n0.992886 0.010757 0.250000 K\n0.492886 0.489243 0.750000 K\n0.007114 0.989243 0.750000 K\n0.000000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.454712 0.994434 0.250000 F\n0.045288 0.494434 0.250000 F\n0.545288 0.005566 0.750000 F\n0.954712 0.505566 0.750000 F\n0.752491 0.752130 0.025097 F\n0.747509 0.252130 0.474903 F\n0.247509 0.247870 0.525097 F\n0.252491 0.747870 0.974903 F\n0.247509 0.247870 0.974903 F\n0.252491 0.747870 0.525097 F\n0.752491 0.752130 0.474903 F\n0.747509 0.252130 0.025097 F\n",
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{
"id": "mp-1202030",
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"structure_string": "Ce8 Al4 Si8 O36\n1.0\n5.695869 0.000000 0.000000\n0.000000 7.839236 0.000000\n0.000000 6.203622 15.355710\nCe Al Si O\n8 4 8 36\ndirect\n0.206411 0.226186 0.938992 Ce\n0.706411 0.773814 0.561008 Ce\n0.793589 0.773814 0.061008 Ce\n0.293589 0.226186 0.438992 Ce\n0.298447 0.809791 0.862796 Ce\n0.798447 0.190209 0.637204 Ce\n0.701553 0.190209 0.137204 Ce\n0.201553 0.809791 0.362796 Ce\n0.997113 0.510796 0.748564 Al\n0.497113 0.489204 0.751436 Al\n0.002887 0.489204 0.251436 Al\n0.502887 0.510796 0.248564 Al\n0.749265 0.514488 0.917221 Si\n0.249265 0.485512 0.582779 Si\n0.250735 0.485512 0.082779 Si\n0.750735 0.514488 0.417221 Si\n0.726179 0.086396 0.845802 Si\n0.226179 0.913604 0.654198 Si\n0.273821 0.913604 0.154198 Si\n0.773821 0.086396 0.345802 Si\n0.682859 0.668342 0.958128 O\n0.182859 0.331658 0.541872 O\n0.317141 0.331658 0.041872 O\n0.817141 0.668342 0.458128 O\n0.807637 0.309709 0.990886 O\n0.307637 0.690291 0.509114 O\n0.192363 0.690291 0.009114 O\n0.692363 0.309709 0.490886 O\n0.507862 0.523311 0.860221 O\n0.007862 0.476689 0.639779 O\n0.492138 0.476689 0.139779 O\n0.992138 0.523311 0.360221 O\n0.991345 0.560579 0.857214 O\n0.491345 0.439421 0.642786 O\n0.008655 0.439421 0.142786 O\n0.508655 0.560579 0.357214 O\n0.667293 0.996663 0.773072 O\n0.167293 0.003337 0.726928 O\n0.332707 0.003337 0.226928 O\n0.832707 0.996663 0.273072 O\n0.753441 0.311855 0.791997 O\n0.253441 0.688145 0.708003 O\n0.246559 0.688145 0.208003 O\n0.746559 0.311855 0.291997 O\n0.964068 0.008497 0.905356 O\n0.464068 0.991503 0.594644 O\n0.035932 0.991503 0.094644 O\n0.535932 0.008497 0.405356 O\n0.494381 0.031973 0.910523 O\n0.994381 0.968027 0.589477 O\n0.505619 0.968027 0.089477 O\n0.005619 0.031973 0.410523 O\n0.736905 0.655628 0.703703 O\n0.236905 0.344372 0.796297 O\n0.263095 0.344372 0.296297 O\n0.763095 0.655628 0.203703 O\n",
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"spacegroup": 14
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{
"id": "mp-601396",
"created_at": "2022-09-04T14:46:19.131085Z",
"structure_string": "Cu4 H40 C8 N16 O40\n1.0\n7.290556 0.000000 0.000000\n0.000000 7.998762 0.000000\n0.000000 0.000000 17.739297\nCu H C N O\n4 40 8 16 40\ndirect\n0.238835 0.753121 0.749984 Cu\n0.738835 0.746879 0.250016 Cu\n0.761165 0.253121 0.750016 Cu\n0.261165 0.246879 0.249984 Cu\n0.091637 0.168301 0.703930 H\n0.993509 0.003762 0.479241 H\n0.006491 0.503762 0.020759 H\n0.607287 0.144659 0.426641 H\n0.408363 0.831699 0.203930 H\n0.075130 0.753615 0.218670 H\n0.584771 0.131300 0.285369 H\n0.110968 0.854996 0.423564 H\n0.424870 0.246385 0.718670 H\n0.561811 0.280125 0.599951 H\n0.939064 0.218527 0.897285 H\n0.889032 0.354996 0.076436 H\n0.084771 0.368700 0.714631 H\n0.924870 0.253615 0.281330 H\n0.439064 0.281473 0.102715 H\n0.493509 0.496238 0.520759 H\n0.415229 0.631300 0.214631 H\n0.392713 0.644659 0.073359 H\n0.005138 0.007002 0.982159 H\n0.892713 0.855341 0.926641 H\n0.061811 0.219875 0.400049 H\n0.610968 0.645004 0.576436 H\n0.994862 0.507002 0.517841 H\n0.389032 0.145004 0.923564 H\n0.505138 0.492998 0.017841 H\n0.438189 0.780125 0.900049 H\n0.422726 0.327005 0.798777 H\n0.494862 0.992998 0.482159 H\n0.915229 0.868700 0.785369 H\n0.577274 0.827005 0.701223 H\n0.922726 0.172995 0.201223 H\n0.591637 0.331699 0.296070 H\n0.060936 0.718527 0.602715 H\n0.938189 0.719875 0.099951 H\n0.077274 0.672995 0.298777 H\n0.107287 0.355341 0.573359 H\n0.560936 0.781473 0.397285 H\n0.575130 0.746385 0.781330 H\n0.908363 0.668301 0.796070 H\n0.506491 0.996238 0.979241 H\n0.604850 0.908534 0.384020 C\n0.895150 0.091466 0.884020 C\n0.114246 0.095468 0.384977 C\n0.385754 0.904532 0.884977 C\n0.614246 0.404532 0.615023 C\n0.885754 0.595468 0.115023 C\n0.104850 0.591466 0.615980 C\n0.395150 0.408534 0.115980 C\n0.430631 0.523395 0.064858 N\n0.279598 0.517926 0.395737 N\n0.569369 0.023395 0.435142 N\n0.718567 0.511369 0.895457 N\n0.781433 0.488631 0.395457 N\n0.930631 0.976605 0.935142 N\n0.779598 0.982074 0.604263 N\n0.569005 0.524455 0.567818 N\n0.281433 0.011369 0.604543 N\n0.430995 0.024455 0.932182 N\n0.218567 0.988631 0.104543 N\n0.069369 0.476605 0.564858 N\n0.220402 0.482074 0.895737 N\n0.930995 0.475545 0.067818 N\n0.069005 0.975545 0.432182 N\n0.720402 0.017926 0.104263 N\n0.189353 0.491499 0.334335 O\n0.790377 0.571375 0.173899 O\n0.709623 0.428625 0.673899 O\n0.290377 0.928625 0.826101 O\n0.856501 0.102827 0.571482 O\n0.466272 0.738879 0.233094 O\n0.187629 0.985621 0.664951 O\n0.288367 0.663911 0.421963 O\n0.788367 0.836089 0.578037 O\n0.356501 0.397173 0.428518 O\n0.816252 0.058922 0.821489 O\n0.316252 0.441078 0.178511 O\n0.687629 0.514379 0.335049 O\n0.295402 0.158934 0.579618 O\n0.683748 0.941078 0.321489 O\n0.183748 0.558922 0.678511 O\n0.310647 0.508501 0.834335 O\n0.357543 0.890868 0.571775 O\n0.211633 0.336089 0.921963 O\n0.143499 0.602827 0.928518 O\n0.312371 0.014379 0.164951 O\n0.209623 0.071375 0.326101 O\n0.642457 0.390868 0.928225 O\n0.512632 0.741402 0.732842 O\n0.704598 0.658934 0.920382 O\n0.857543 0.609132 0.428225 O\n0.812371 0.485621 0.835049 O\n0.987368 0.258598 0.232842 O\n0.966272 0.761121 0.766906 O\n0.643499 0.897173 0.071482 O\n0.487368 0.241402 0.767158 O\n0.689353 0.008501 0.665665 O\n0.033728 0.261121 0.733094 O\n0.795402 0.341066 0.420382 O\n0.142457 0.109132 0.071775 O\n0.810647 0.991499 0.165665 O\n0.204598 0.841066 0.079618 O\n0.533728 0.238879 0.266906 O\n0.711633 0.163911 0.078037 O\n0.012632 0.758598 0.267158 O\n",
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{
"id": "mp-582983",
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