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{
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{
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{
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"structure_string": "Pa1 In1 Ru2\n1.0\n0.000000 3.347182 3.347182\n3.347182 0.000000 3.347182\n3.347182 3.347182 0.000000\nPa In Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Pa\n0.500000 0.500000 0.500000 In\n0.250000 0.250000 0.250000 Ru\n0.750000 0.750000 0.750000 Ru\n",
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{
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"structure_string": "Ca8 Tb4 Mn12 O36\n1.0\n5.362053 0.000000 0.000000\n0.000000 7.649143 0.000000\n0.000000 0.000000 16.355899\nCa Tb Mn O\n8 4 12 36\ndirect\n0.509062 0.750000 0.484669 Ca\n0.509071 0.750000 0.818547 Ca\n0.990929 0.750000 0.318547 Ca\n0.990938 0.750000 0.984669 Ca\n0.490929 0.250000 0.181453 Ca\n0.490938 0.250000 0.515331 Ca\n0.009062 0.250000 0.015331 Ca\n0.009071 0.250000 0.681453 Ca\n0.510444 0.750000 0.149904 Tb\n0.989556 0.750000 0.649904 Tb\n0.489556 0.250000 0.850096 Tb\n0.010444 0.250000 0.350096 Tb\n0.000791 0.001449 0.166726 Mn\n0.000000 0.000000 0.500000 Mn\n0.999209 0.998551 0.833274 Mn\n0.500000 0.500000 0.000000 Mn\n0.500791 0.501449 0.333274 Mn\n0.499209 0.498551 0.666726 Mn\n0.000791 0.498551 0.166726 Mn\n0.000000 0.500000 0.500000 Mn\n0.999209 0.501449 0.833274 Mn\n0.500000 0.000000 0.000000 Mn\n0.500791 0.998551 0.333274 Mn\n0.499209 0.001449 0.666726 Mn\n0.787887 0.951980 0.071430 O\n0.796696 0.963378 0.401289 O\n0.796706 0.954488 0.734627 O\n0.703294 0.545512 0.234627 O\n0.712113 0.548020 0.571430 O\n0.703304 0.536622 0.901289 O\n0.203294 0.454488 0.265373 O\n0.203304 0.463378 0.598711 O\n0.212113 0.451980 0.928570 O\n0.296696 0.036622 0.098711 O\n0.287887 0.048020 0.428570 O\n0.296706 0.045512 0.765373 O\n0.203294 0.045512 0.265373 O\n0.203304 0.036622 0.598711 O\n0.212113 0.048020 0.928570 O\n0.296696 0.463378 0.098711 O\n0.287887 0.451980 0.428570 O\n0.296706 0.454488 0.765373 O\n0.787887 0.548020 0.071430 O\n0.796696 0.536622 0.401289 O\n0.796706 0.545512 0.734627 O\n0.703294 0.954488 0.234627 O\n0.712113 0.951980 0.571430 O\n0.703304 0.963378 0.901289 O\n0.420838 0.750000 0.008578 O\n0.421505 0.750000 0.338703 O\n0.412236 0.750000 0.673030 O\n0.087764 0.750000 0.173030 O\n0.079162 0.750000 0.508578 O\n0.078495 0.750000 0.838703 O\n0.587764 0.250000 0.326970 O\n0.578495 0.250000 0.661297 O\n0.579162 0.250000 0.991422 O\n0.921505 0.250000 0.161297 O\n0.920838 0.250000 0.491422 O\n0.912236 0.250000 0.826970 O\n",
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{
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"structure_string": "Re12 Pb10 O38\n1.0\n9.400706 0.000000 0.000000\n0.000000 9.395467 0.000000\n0.000000 9.403813 9.410040\nRe Pb O\n12 10 38\ndirect\n0.115441 0.500000 0.250000 Re\n0.247488 0.138984 0.244416 Re\n0.246378 0.367840 0.883206 Re\n0.246378 0.632160 0.616794 Re\n0.247488 0.861016 0.255584 Re\n0.381588 0.500000 0.250000 Re\n0.618412 0.500000 0.750000 Re\n0.752512 0.138984 0.744416 Re\n0.753622 0.367840 0.383206 Re\n0.753622 0.632160 0.116794 Re\n0.752512 0.861016 0.755584 Re\n0.884559 0.500000 0.750000 Re\n0.101847 0.998920 0.607474 Pb\n0.101847 0.001080 0.892526 Pb\n0.390697 0.708112 0.896528 Pb\n0.390697 0.291888 0.603472 Pb\n0.500000 0.000000 0.500000 Pb\n0.500000 0.000000 0.000000 Pb\n0.609303 0.708112 0.396528 Pb\n0.609303 0.291888 0.103472 Pb\n0.898153 0.998920 0.107474 Pb\n0.898153 0.001080 0.392526 Pb\n0.040166 0.354874 0.891989 O\n0.040166 0.645126 0.608011 O\n0.078901 0.000000 0.250000 O\n0.108068 0.286790 0.253404 O\n0.108068 0.713210 0.246596 O\n0.249892 0.065451 0.039297 O\n0.249892 0.934549 0.460703 O\n0.251342 0.000000 0.750000 O\n0.250114 0.328251 0.752113 O\n0.250856 0.669801 0.080408 O\n0.250856 0.330199 0.419592 O\n0.250114 0.671749 0.747887 O\n0.252568 0.646417 0.461282 O\n0.252568 0.353583 0.038718 O\n0.394998 0.711251 0.250022 O\n0.394998 0.288749 0.249978 O\n0.417620 0.000000 0.250000 O\n0.461367 0.354605 0.895302 O\n0.461367 0.645395 0.604698 O\n0.538633 0.354605 0.395302 O\n0.538633 0.645395 0.104698 O\n0.582380 0.000000 0.750000 O\n0.605002 0.711251 0.750022 O\n0.605002 0.288749 0.749978 O\n0.747432 0.646417 0.961282 O\n0.747432 0.353583 0.538718 O\n0.749144 0.669801 0.580408 O\n0.749886 0.328251 0.252113 O\n0.749144 0.330199 0.919592 O\n0.749886 0.671749 0.247887 O\n0.748658 0.000000 0.250000 O\n0.750108 0.065451 0.539297 O\n0.750108 0.934549 0.960703 O\n0.891932 0.286790 0.753404 O\n0.891932 0.713210 0.746596 O\n0.921099 0.000000 0.750000 O\n0.959834 0.354874 0.391989 O\n0.959834 0.645126 0.108011 O\n",
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{
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"structure_string": "Li4 Mn12 P12 O44\n1.0\n9.150704 0.000000 0.000000\n0.000000 8.073261 0.000000\n0.000000 1.247739 11.555956\nLi Mn P O\n4 12 12 44\ndirect\n0.744784 0.885980 0.505209 Li\n0.755216 0.885980 0.005209 Li\n0.244784 0.114020 0.994791 Li\n0.255216 0.114020 0.494791 Li\n0.373443 0.929645 0.759706 Mn\n0.126557 0.929645 0.259706 Mn\n0.350387 0.543228 0.931993 Mn\n0.397419 0.563289 0.647022 Mn\n0.149613 0.543228 0.431993 Mn\n0.897419 0.436711 0.852978 Mn\n0.102581 0.563289 0.147022 Mn\n0.850387 0.456772 0.568007 Mn\n0.602581 0.436711 0.352978 Mn\n0.649613 0.456772 0.068007 Mn\n0.873443 0.070355 0.740294 Mn\n0.626557 0.070355 0.240294 Mn\n0.068480 0.788970 0.895961 P\n0.068965 0.774848 0.645684 P\n0.431520 0.788970 0.395961 P\n0.674199 0.685209 0.786240 P\n0.431035 0.774848 0.145684 P\n0.825801 0.685209 0.286240 P\n0.174199 0.314791 0.713760 P\n0.568965 0.225152 0.854316 P\n0.325801 0.314791 0.213760 P\n0.568480 0.211030 0.604039 P\n0.931035 0.225152 0.354316 P\n0.931520 0.211030 0.104039 P\n0.000006 0.960685 0.883890 O\n0.991621 0.940794 0.620866 O\n0.499994 0.960685 0.383890 O\n0.722702 0.866017 0.770421 O\n0.237690 0.788644 0.896661 O\n0.508379 0.940794 0.120866 O\n0.777298 0.866017 0.270421 O\n0.237344 0.783242 0.647405 O\n0.262310 0.788644 0.396661 O\n0.500180 0.678287 0.783780 O\n0.021553 0.696137 0.779489 O\n0.262656 0.783242 0.147405 O\n0.493650 0.673366 0.496180 O\n0.729947 0.599798 0.906325 O\n0.014760 0.649597 0.564782 O\n0.999820 0.678287 0.283780 O\n0.478447 0.696137 0.279489 O\n0.734632 0.580428 0.692514 O\n0.006350 0.673366 0.996180 O\n0.770053 0.599798 0.406325 O\n0.485240 0.649597 0.064782 O\n0.765368 0.580428 0.192514 O\n0.234632 0.419572 0.807486 O\n0.514760 0.350403 0.935218 O\n0.229947 0.400202 0.593675 O\n0.993650 0.326634 0.003820 O\n0.265368 0.419572 0.307486 O\n0.521553 0.303863 0.720511 O\n0.000180 0.321713 0.716220 O\n0.985240 0.350403 0.435218 O\n0.270053 0.400202 0.093675 O\n0.506350 0.326634 0.503820 O\n0.737344 0.216758 0.852595 O\n0.978447 0.303863 0.220511 O\n0.499820 0.321713 0.216220 O\n0.737690 0.211356 0.603339 O\n0.762656 0.216758 0.352595 O\n0.222702 0.133983 0.729579 O\n0.491621 0.059206 0.879134 O\n0.762310 0.211356 0.103339 O\n0.277298 0.133983 0.229579 O\n0.500006 0.039315 0.616110 O\n0.008379 0.059206 0.379134 O\n0.999994 0.039315 0.116110 O\n",
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}