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{
"id": "jvasp-25868",
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{
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"structure_string": "K2 Na1 Fe1 F6\n1.0\n5.016885 -0.000000 2.896500\n1.672295 4.729964 2.896500\n-0.000000 0.000000 5.793000\nK Na Fe F\n2 1 1 6\ndirect\n0.750002 0.749999 0.749999 K\n0.250001 0.250000 0.250000 K\n0.500001 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Fe\n0.229171 0.770830 0.770830 F\n0.229171 0.770830 0.229170 F\n0.770831 0.229170 0.770830 F\n0.229170 0.229170 0.770830 F\n0.770831 0.229170 0.229169 F\n0.770832 0.770830 0.229169 F\n",
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{
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"structure_string": "Li2 Mn6 O2 F10\n1.0\n6.221437 -0.017105 -0.007206\n-0.229886 6.265611 -0.020806\n-0.270383 -0.271557 6.240233\nLi Mn O F\n2 6 2 10\ndirect\n0.488262 0.502214 0.514124 Li\n0.007029 0.016076 0.023043 Li\n0.726752 0.445514 0.913432 Mn\n0.065591 0.242351 0.550091 Mn\n0.589387 0.077830 0.263421 Mn\n0.437101 0.905933 0.752422 Mn\n0.926863 0.759215 0.426211 Mn\n0.262753 0.565760 0.057623 Mn\n0.460785 0.597162 0.819754 O\n0.909324 0.061492 0.321494 O\n0.933113 0.681961 0.073695 F\n0.688325 0.096944 0.909589 F\n0.067034 0.307859 0.900486 F\n0.406402 0.184217 0.548833 F\n0.817120 0.474150 0.582997 F\n0.187132 0.534737 0.390173 F\n0.545112 0.403570 0.205064 F\n0.090667 0.909607 0.705829 F\n0.576628 0.794806 0.449011 F\n0.314624 0.938596 0.092688 F\n",
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"structure_string": "K2 Tb4 Cu2 S8\n1.0\n3.960971 -0.000000 0.000000\n-1.980485 6.722748 -0.000000\n0.000000 0.000000 13.728220\nTb K Cu S\n4 2 2 8\ndirect\n0.365803 0.731604 0.936631 Tb\n0.634199 0.268397 0.436631 Tb\n0.365803 0.731604 0.563369 Tb\n0.634199 0.268397 0.063369 Tb\n0.889899 0.779798 0.250000 K\n0.110102 0.220202 0.750000 K\n0.838283 0.676565 0.750000 Cu\n0.161718 0.323435 0.250000 Cu\n0.000000 0.000000 0.500000 S\n0.000000 0.000000 0.000000 S\n0.264532 0.529063 0.111861 S\n0.735470 0.470937 0.888139 S\n0.433687 0.867371 0.750000 S\n0.264532 0.529063 0.388139 S\n0.566315 0.132629 0.250000 S\n0.735470 0.470937 0.611861 S\n",
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{
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"structure_string": "Na4 Fe2 Ni2 F14\n1.0\n6.268557 -0.000000 3.566828\n2.145128 6.049201 3.521806\n-0.016633 0.000589 7.321014\nNa Fe Ni F\n4 2 2 14\ndirect\n0.250166 0.495813 0.504187 Na\n0.750867 0.997069 0.501199 Na\n0.749835 0.495813 0.504187 Na\n0.249134 0.498801 0.002931 Na\n0.250086 0.997501 0.502327 Fe\n0.749915 0.497673 0.002499 Fe\n0.250098 0.997706 0.002294 Ni\n0.749903 0.997706 0.002294 Ni\n0.000000 0.893724 0.106276 F\n0.343771 0.671557 0.640901 F\n0.156098 0.323540 0.364265 F\n0.665552 0.315233 0.950935 F\n0.931720 0.049065 0.684767 F\n0.568209 0.946379 0.319785 F\n0.500001 0.101876 0.898123 F\n0.656230 0.359099 0.328443 F\n0.165628 0.946379 0.319785 F\n0.834374 0.680216 0.053621 F\n0.843903 0.635735 0.676460 F\n0.068281 0.315233 0.950935 F\n0.334449 0.049065 0.684767 F\n0.431792 0.680216 0.053621 F\n",
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{
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"structure_string": "Ni3 Pb2 Se1 S1\n1.0\n4.922214 -0.018766 2.886063\n1.644434 4.639438 2.886063\n-0.026670 -0.018766 5.705860\nNi Pb Se S\n3 2 1 1\ndirect\n0.993773 0.993774 0.503605 Ni\n0.503604 0.993774 0.993775 Ni\n0.993774 0.503604 0.993775 Ni\n0.000126 0.000126 0.000126 Pb\n0.504396 0.504396 0.504397 Pb\n0.278430 0.278430 0.278430 Se\n0.725891 0.725891 0.725892 S\n",
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"structure_string": "Na6 Np2 H4 O12\n1.0\n0.000000 -2.955824 -5.225510\n0.000000 -2.955824 5.225510\n-10.052457 2.955824 0.000000\nNa Np H O\n6 2 4 12\ndirect\n0.131410 0.868589 0.000000 Na\n0.904956 0.318315 0.176046 Na\n0.978908 0.892268 0.323953 Na\n0.381410 0.618587 0.500000 Na\n0.107731 0.021091 0.676045 Na\n0.681686 0.095044 0.823955 Na\n0.470762 0.529238 0.000000 Np\n0.720762 0.279236 0.500000 Np\n0.573206 0.482190 0.711085 H\n0.112120 0.521106 0.788915 H\n0.478895 0.887880 0.211086 H\n0.517810 0.426795 0.288916 H\n0.671813 0.733674 0.883806 O\n0.814933 0.615286 0.112660 O\n0.266326 0.328188 0.116194 O\n0.518674 0.892711 0.122569 O\n0.646108 0.520143 0.377431 O\n0.400134 0.961993 0.383806 O\n0.952275 0.252625 0.387340 O\n0.747375 0.047726 0.612660 O\n0.038007 0.599866 0.616195 O\n0.479858 0.353892 0.622569 O\n0.107290 0.481325 0.877431 O\n0.384715 0.185067 0.887340 O\n",
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"structure_string": "Zn1 Cu2 Ge1 Se4\n1.0\n5.144800 -0.000000 -2.329874\n-1.055107 5.035446 -2.329874\n0.033641 0.041421 6.919565\nZn Cu Ge Se\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Zn\n0.750000 0.250000 0.500001 Cu\n0.249999 0.750001 0.500001 Cu\n0.500000 0.500000 0.000001 Ge\n0.383381 0.383382 0.259669 Se\n0.123712 0.616619 0.740332 Se\n0.616618 0.123713 0.740332 Se\n0.876287 0.876288 0.259670 Se\n",
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