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{
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{
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{
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{
"id": "mp-1396255",
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"structure_string": "Zn1 Cr2 F12\n1.0\n-5.134839 0.000000 0.000000\n2.560749 4.737425 0.000000\n-0.004645 -2.797259 -8.421031\nZn Cr F\n1 2 12\ndirect\n0.500000 0.500000 0.500000 Zn\n0.751858 0.252905 0.239892 Cr\n0.248142 0.747095 0.760108 Cr\n0.918838 0.079629 0.190620 F\n0.420038 0.578504 0.687265 F\n0.526114 0.898411 0.366750 F\n0.027066 0.404146 0.863104 F\n0.454536 0.186956 0.083023 F\n0.953507 0.685891 0.579035 F\n0.046493 0.314109 0.420965 F\n0.545464 0.813044 0.916977 F\n0.972934 0.595854 0.136896 F\n0.473886 0.101589 0.633250 F\n0.579962 0.421496 0.312735 F\n0.081162 0.920371 0.809380 F\n",
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"formula_full": "Zn1 Cr2 F12",
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{
"id": "mp-680717",
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"structure_string": "Tm16 B48 O96\n1.0\n7.398097 0.000000 0.000000\n0.000000 12.219733 0.000000\n0.000000 0.000000 15.898558\nTm B O\n16 48 96\ndirect\n0.750000 0.764994 0.628675 Tm\n0.750000 0.010191 0.120628 Tm\n0.750000 0.435525 0.326966 Tm\n0.750000 0.489809 0.620628 Tm\n0.250000 0.264994 0.871325 Tm\n0.750000 0.064475 0.826966 Tm\n0.250000 0.564475 0.673034 Tm\n0.250000 0.235006 0.371325 Tm\n0.250000 0.935525 0.173034 Tm\n0.250000 0.989809 0.879372 Tm\n0.250000 0.510191 0.379372 Tm\n0.750000 0.411699 0.951466 Tm\n0.750000 0.088301 0.451466 Tm\n0.250000 0.911699 0.548534 Tm\n0.250000 0.588301 0.048534 Tm\n0.750000 0.735006 0.128675 Tm\n0.568756 0.128154 0.258662 B\n0.059175 0.823463 0.033109 B\n0.929725 0.685516 0.782407 B\n0.568756 0.371846 0.758662 B\n0.931244 0.371846 0.758662 B\n0.423483 0.142226 0.109554 B\n0.576517 0.642226 0.390446 B\n0.426556 0.345827 0.055880 B\n0.559175 0.323463 0.466891 B\n0.923483 0.857774 0.890446 B\n0.578349 0.482813 0.151909 B\n0.921651 0.017187 0.651909 B\n0.421651 0.517187 0.848091 B\n0.068756 0.628154 0.241338 B\n0.070275 0.185516 0.717593 B\n0.940825 0.323463 0.466891 B\n0.573444 0.845827 0.444120 B\n0.070275 0.314484 0.217593 B\n0.429725 0.185516 0.717593 B\n0.078349 0.517187 0.848091 B\n0.926556 0.845827 0.444120 B\n0.931244 0.128154 0.258662 B\n0.923483 0.642226 0.390446 B\n0.440825 0.823463 0.033109 B\n0.573444 0.654173 0.944120 B\n0.431244 0.871846 0.741338 B\n0.078349 0.982813 0.348091 B\n0.076517 0.357774 0.609554 B\n0.559175 0.176537 0.966891 B\n0.426556 0.154173 0.555880 B\n0.926556 0.654173 0.944120 B\n0.423483 0.357774 0.609554 B\n0.570275 0.685516 0.782407 B\n0.576517 0.857774 0.890446 B\n0.570275 0.814484 0.282407 B\n0.059175 0.676537 0.533109 B\n0.076517 0.142226 0.109554 B\n0.073444 0.345827 0.055880 B\n0.421651 0.982813 0.348091 B\n0.578349 0.017187 0.651909 B\n0.440825 0.676537 0.533109 B\n0.431244 0.628154 0.241338 B\n0.429725 0.314484 0.217593 B\n0.929725 0.814484 0.282407 B\n0.940825 0.176537 0.966891 B\n0.073444 0.154173 0.555880 B\n0.921651 0.482813 0.151909 B\n0.068756 0.871846 0.741338 B\n0.024653 0.210055 0.476534 O\n0.061423 0.930848 0.431635 O\n0.975347 0.710055 0.023466 O\n0.561423 0.069152 0.568365 O\n0.566180 0.121473 0.047930 O\n0.250000 0.639398 0.276080 O\n0.567543 0.063677 0.336735 O\n0.750000 0.642740 0.755068 O\n0.438577 0.569152 0.931635 O\n0.750000 0.600210 0.952038 O\n0.543946 0.879523 0.097194 O\n0.475347 0.210055 0.476534 O\n0.750000 0.139398 0.223920 O\n0.750000 0.603396 0.422224 O\n0.034418 0.076120 0.185626 O\n0.433820 0.878527 0.952070 O\n0.432507 0.601390 0.781898 O\n0.567543 0.436323 0.836735 O\n0.750000 0.303657 0.432464 O\n0.567493 0.398610 0.218102 O\n0.938577 0.430848 0.068365 O\n0.250000 0.803657 0.067536 O\n0.567493 0.101390 0.718102 O\n0.925878 0.764829 0.371452 O\n0.074122 0.264829 0.128548 O\n0.250000 0.396604 0.577776 O\n0.750000 0.542845 0.158064 O\n0.522540 0.770384 0.722361 O\n0.534418 0.923880 0.814374 O\n0.250000 0.357260 0.244932 O\n0.750000 0.896604 0.922224 O\n0.543946 0.620477 0.597194 O\n0.965582 0.923880 0.814374 O\n0.574122 0.735171 0.871452 O\n0.250000 0.042845 0.341936 O\n0.066180 0.621473 0.452070 O\n0.938577 0.069152 0.568365 O\n0.465582 0.076120 0.185626 O\n0.066180 0.878527 0.952070 O\n0.425878 0.235171 0.628548 O\n0.456054 0.379523 0.402806 O\n0.566180 0.378527 0.547930 O\n0.956054 0.879523 0.097194 O\n0.061423 0.569152 0.931635 O\n0.933820 0.121473 0.047930 O\n0.022540 0.270384 0.777639 O\n0.977460 0.729616 0.222361 O\n0.750000 0.857260 0.255068 O\n0.067493 0.601390 0.781898 O\n0.750000 0.899790 0.452038 O\n0.250000 0.100210 0.547962 O\n0.250000 0.399790 0.047962 O\n0.034418 0.423880 0.685626 O\n0.977460 0.770384 0.722361 O\n0.433820 0.621473 0.452070 O\n0.432457 0.936323 0.663265 O\n0.932507 0.398610 0.218102 O\n0.250000 0.696343 0.567536 O\n0.475347 0.289945 0.976534 O\n0.022540 0.229616 0.277639 O\n0.933820 0.378527 0.547930 O\n0.561423 0.430848 0.068365 O\n0.477460 0.229616 0.277639 O\n0.250000 0.142740 0.744932 O\n0.250000 0.103396 0.077776 O\n0.024653 0.289945 0.976534 O\n0.067543 0.563677 0.163265 O\n0.438577 0.930848 0.431635 O\n0.043946 0.120477 0.902806 O\n0.465582 0.423880 0.685626 O\n0.750000 0.196343 0.932464 O\n0.524653 0.789945 0.523466 O\n0.425878 0.264829 0.128548 O\n0.975347 0.789945 0.523466 O\n0.534418 0.576120 0.314374 O\n0.574122 0.764829 0.371452 O\n0.432507 0.898610 0.281898 O\n0.067543 0.936323 0.663265 O\n0.250000 0.860602 0.776080 O\n0.456054 0.120477 0.902806 O\n0.750000 0.360602 0.723920 O\n0.750000 0.957155 0.658064 O\n0.250000 0.457155 0.841936 O\n0.043946 0.379523 0.402806 O\n0.074122 0.235171 0.628548 O\n0.925878 0.735171 0.871452 O\n0.956054 0.620477 0.597194 O\n0.432457 0.563677 0.163265 O\n0.932507 0.101390 0.718102 O\n0.477460 0.270384 0.777639 O\n0.067493 0.898610 0.281898 O\n0.965582 0.576120 0.314374 O\n0.524653 0.710055 0.023466 O\n0.932457 0.063677 0.336735 O\n0.522540 0.729616 0.222361 O\n0.932457 0.436323 0.836735 O\n",
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{
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"structure_string": "Cr16 Si16 N32\n1.0\n5.009112 0.000000 0.000000\n0.000000 10.193967 0.000000\n0.000000 0.000000 13.288884\nCr Si N\n16 16 32\ndirect\n0.682756 0.979434 0.447110 Cr\n0.182756 0.520566 0.552890 Cr\n0.317244 0.479434 0.052890 Cr\n0.817244 0.020566 0.947110 Cr\n0.317244 0.020566 0.552890 Cr\n0.817244 0.479434 0.447110 Cr\n0.682756 0.520566 0.947110 Cr\n0.182756 0.979434 0.052890 Cr\n0.829420 0.281718 0.308833 Cr\n0.329420 0.218282 0.691167 Cr\n0.170580 0.781718 0.191167 Cr\n0.670580 0.718282 0.808833 Cr\n0.170580 0.718282 0.691167 Cr\n0.670580 0.781718 0.308833 Cr\n0.829420 0.218282 0.808833 Cr\n0.329420 0.281718 0.191167 Cr\n0.668524 0.024919 0.187696 Si\n0.168524 0.475081 0.812304 Si\n0.331476 0.524919 0.312304 Si\n0.831476 0.975081 0.687696 Si\n0.331476 0.975081 0.812304 Si\n0.831476 0.524919 0.187696 Si\n0.668524 0.475081 0.687696 Si\n0.168524 0.024919 0.312304 Si\n0.821235 0.275419 0.062682 Si\n0.321235 0.224581 0.937318 Si\n0.178765 0.775419 0.437318 Si\n0.678765 0.724581 0.562682 Si\n0.178765 0.724581 0.937318 Si\n0.678765 0.775419 0.062682 Si\n0.821235 0.224581 0.562682 Si\n0.321235 0.275419 0.437318 Si\n0.664953 0.476004 0.297827 N\n0.164953 0.023996 0.702173 N\n0.335047 0.976004 0.202173 N\n0.835047 0.523996 0.797827 N\n0.335047 0.523996 0.702173 N\n0.835047 0.976004 0.297827 N\n0.664953 0.023996 0.797827 N\n0.164953 0.476004 0.202173 N\n0.669662 0.282689 0.453489 N\n0.169662 0.217311 0.546511 N\n0.330338 0.782689 0.046511 N\n0.830338 0.717311 0.953489 N\n0.330338 0.717311 0.546511 N\n0.830338 0.782689 0.453489 N\n0.669662 0.217311 0.953489 N\n0.169662 0.282689 0.046511 N\n0.709845 0.439399 0.082516 N\n0.209845 0.060601 0.917484 N\n0.290155 0.939399 0.417484 N\n0.790155 0.560601 0.582516 N\n0.290155 0.560601 0.917484 N\n0.790155 0.939399 0.082516 N\n0.709845 0.060601 0.582516 N\n0.209845 0.439399 0.417484 N\n0.707637 0.193937 0.171175 N\n0.207637 0.306063 0.828825 N\n0.292363 0.693937 0.328825 N\n0.792363 0.806063 0.671175 N\n0.292363 0.806063 0.828825 N\n0.792363 0.693937 0.171175 N\n0.707637 0.306063 0.671175 N\n0.207637 0.193937 0.328825 N\n",
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{
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