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{
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{
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"structure_string": "Na4 Al12 Ni4 Cl48\n1.0\n12.212895 0.000000 0.000000\n0.000000 12.690749 0.000000\n0.000000 4.003412 13.228771\nNa Al Ni Cl\n4 12 4 48\ndirect\n0.207704 0.516971 0.709287 Na\n0.792296 0.483029 0.290713 Na\n0.292296 0.016971 0.709287 Na\n0.707704 0.983029 0.290713 Na\n0.986901 0.176211 0.277971 Al\n0.753107 0.613059 0.019186 Al\n0.080307 0.675121 0.389118 Al\n0.486901 0.323789 0.722029 Al\n0.746893 0.113059 0.019186 Al\n0.419693 0.175121 0.389118 Al\n0.580307 0.824879 0.610882 Al\n0.919693 0.324879 0.610882 Al\n0.513099 0.676211 0.277971 Al\n0.253107 0.886941 0.980814 Al\n0.013099 0.823789 0.722029 Al\n0.246893 0.386941 0.980814 Al\n0.737766 0.258722 0.785699 Ni\n0.237766 0.241278 0.214301 Ni\n0.262234 0.741278 0.214301 Ni\n0.762234 0.758722 0.785699 Ni\n0.114477 0.246395 0.352335 Cl\n0.614713 0.667424 0.724062 Cl\n0.337904 0.239349 0.063647 Cl\n0.831071 0.580796 0.887656 Cl\n0.885523 0.753605 0.647665 Cl\n0.910895 0.633137 0.400694 Cl\n0.614477 0.253605 0.647665 Cl\n0.092413 0.139702 0.163203 Cl\n0.147538 0.014230 0.897295 Cl\n0.410895 0.866863 0.599306 Cl\n0.385287 0.332576 0.275938 Cl\n0.885287 0.167424 0.724062 Cl\n0.385523 0.746395 0.352335 Cl\n0.907587 0.860298 0.836797 Cl\n0.852226 0.316831 0.469999 Cl\n0.352462 0.514230 0.897295 Cl\n0.133707 0.703958 0.791210 Cl\n0.323103 0.071669 0.318620 Cl\n0.352226 0.183169 0.530001 Cl\n0.676897 0.928331 0.681380 Cl\n0.176897 0.571669 0.318620 Cl\n0.668929 0.080796 0.887656 Cl\n0.125553 0.357386 0.880003 Cl\n0.086890 0.970028 0.626477 Cl\n0.168929 0.419204 0.112344 Cl\n0.147774 0.683169 0.530001 Cl\n0.162096 0.739349 0.063647 Cl\n0.913110 0.029972 0.373523 Cl\n0.366293 0.203958 0.791210 Cl\n0.625553 0.142614 0.119997 Cl\n0.586890 0.529972 0.373523 Cl\n0.866293 0.296042 0.208790 Cl\n0.852462 0.985770 0.102705 Cl\n0.874447 0.642614 0.119997 Cl\n0.407587 0.639702 0.163203 Cl\n0.374447 0.857386 0.880003 Cl\n0.331071 0.919204 0.112344 Cl\n0.647538 0.485770 0.102705 Cl\n0.823103 0.428331 0.681380 Cl\n0.837904 0.260651 0.936353 Cl\n0.647774 0.816831 0.469999 Cl\n0.589105 0.133137 0.400694 Cl\n0.592413 0.360298 0.836797 Cl\n0.413110 0.470028 0.626477 Cl\n0.662096 0.760651 0.936353 Cl\n0.633707 0.796042 0.208790 Cl\n0.114713 0.832576 0.275938 Cl\n0.089105 0.366863 0.599306 Cl\n",
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{
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"structure_string": "Tb16 In4 Ir4\n1.0\n0.000000 6.867484 6.867484\n6.867484 0.000000 6.867484\n6.867484 6.867484 0.000000\nTb In Ir\n16 4 4\ndirect\n0.099010 0.702970 0.099010 Tb\n0.941430 0.941430 0.558570 Tb\n0.941430 0.558570 0.941430 Tb\n0.310198 0.689802 0.310198 Tb\n0.941430 0.558570 0.558570 Tb\n0.310198 0.310198 0.689802 Tb\n0.099010 0.099010 0.099010 Tb\n0.558570 0.558570 0.941430 Tb\n0.099010 0.099010 0.702970 Tb\n0.689802 0.310198 0.689802 Tb\n0.689802 0.689802 0.310198 Tb\n0.689802 0.310198 0.310198 Tb\n0.310198 0.689802 0.689802 Tb\n0.558570 0.941430 0.558570 Tb\n0.702970 0.099010 0.099010 Tb\n0.558570 0.941430 0.941430 Tb\n0.332576 0.332576 0.332576 In\n0.002271 0.332576 0.332576 In\n0.332576 0.002271 0.332576 In\n0.332576 0.332576 0.002271 In\n0.891252 0.891252 0.891252 Ir\n0.891252 0.891252 0.326244 Ir\n0.326244 0.891252 0.891252 Ir\n0.891252 0.326244 0.891252 Ir\n",
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{
"id": "mp-1009832",
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"structure_string": "Ta1 C1\n1.0\n0.000000 2.419287 2.419287\n2.419287 0.000000 2.419287\n2.419287 2.419287 0.000000\nTa C\n1 1\ndirect\n0.000000 0.000000 0.000000 Ta\n0.250000 0.250000 0.250000 C\n",
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{
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"structure_string": "V4 Zn1 S8\n1.0\n6.743439 -3.208136 0.000000\n6.743439 3.208136 0.000000\n5.217195 0.000000 5.342937\nV Zn S\n4 1 8\ndirect\n0.000000 0.500000 0.500000 V\n0.500000 0.000000 0.500000 V\n0.500000 0.500000 0.000000 V\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.500000 Zn\n0.261297 0.754769 0.754769 S\n0.245231 0.245231 0.738703 S\n0.738703 0.245231 0.245231 S\n0.245231 0.738703 0.245231 S\n0.258207 0.258207 0.258207 S\n0.741793 0.741793 0.741793 S\n0.754769 0.261297 0.754769 S\n0.754769 0.754769 0.261297 S\n",
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{
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{
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"structure_string": "Y6 Si6 N6 O12\n1.0\n3.527340 -6.150142 0.000000\n3.527340 6.150142 0.000000\n0.000000 0.000000 9.203970\nY Si N O\n6 6 6 12\ndirect\n0.825005 0.174995 0.500000 Y\n0.174995 0.825005 0.000000 Y\n0.825005 0.174995 0.000000 Y\n0.174995 0.825005 0.500000 Y\n0.500000 0.500000 0.500000 Y\n0.500000 0.500000 0.000000 Y\n0.164888 0.409347 0.250000 Si\n0.590653 0.835112 0.750000 Si\n0.916424 0.916424 0.250000 Si\n0.835112 0.590653 0.750000 Si\n0.083576 0.083576 0.750000 Si\n0.409347 0.164888 0.250000 Si\n0.598139 0.598139 0.750000 N\n0.836608 0.073875 0.750000 N\n0.073875 0.836608 0.750000 N\n0.926125 0.163392 0.250000 N\n0.401861 0.401861 0.250000 N\n0.163392 0.926125 0.250000 N\n0.165859 0.525658 0.094288 O\n0.474342 0.834141 0.905712 O\n0.474342 0.834141 0.594288 O\n0.525658 0.165859 0.094288 O\n0.803388 0.803388 0.408576 O\n0.834141 0.474342 0.905712 O\n0.834141 0.474342 0.594288 O\n0.196612 0.196612 0.591424 O\n0.196612 0.196612 0.908576 O\n0.803388 0.803388 0.091424 O\n0.525658 0.165859 0.405712 O\n0.165859 0.525658 0.405712 O\n",
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{
"id": "mp-759552",
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"structure_string": "Li4 Cr2 P8 H32 O40\n1.0\n10.701091 0.000000 0.000000\n0.000000 7.184966 0.000000\n0.000000 5.405817 10.849542\nLi Cr P H O\n4 2 8 32 40\ndirect\n0.836297 0.204199 0.042240 Li\n0.336297 0.795801 0.457760 Li\n0.663703 0.204199 0.542240 Li\n0.163703 0.795801 0.957760 Li\n0.500000 0.500000 0.000000 Cr\n0.000000 0.500000 0.500000 Cr\n0.739939 0.683891 0.583675 P\n0.239939 0.316109 0.916325 P\n0.544890 0.040504 0.221974 P\n0.044890 0.959496 0.278026 P\n0.955110 0.040504 0.721974 P\n0.455110 0.959496 0.778026 P\n0.760061 0.683891 0.083675 P\n0.260061 0.316109 0.416325 P\n0.098373 0.746041 0.606855 H\n0.461114 0.665628 0.691715 H\n0.067039 0.482875 0.895298 H\n0.877164 0.506519 0.810758 H\n0.672975 0.464543 0.841613 H\n0.209822 0.136664 0.288586 H\n0.172975 0.535457 0.658387 H\n0.377164 0.493481 0.689242 H\n0.913941 0.910579 0.424918 H\n0.605972 0.902578 0.445137 H\n0.567039 0.517125 0.604702 H\n0.961114 0.334372 0.808285 H\n0.598373 0.253959 0.893145 H\n0.105972 0.097422 0.054863 H\n0.413941 0.089421 0.075082 H\n0.709822 0.863336 0.211414 H\n0.290178 0.136664 0.788586 H\n0.586059 0.910579 0.924918 H\n0.894028 0.902578 0.945137 H\n0.401627 0.746041 0.106855 H\n0.038886 0.665628 0.191715 H\n0.432961 0.482875 0.395298 H\n0.394028 0.097422 0.554863 H\n0.086059 0.089421 0.575082 H\n0.622836 0.506519 0.310758 H\n0.827025 0.464543 0.341613 H\n0.790178 0.863336 0.711414 H\n0.327025 0.535457 0.158387 H\n0.122836 0.493481 0.189242 H\n0.932961 0.517125 0.104702 H\n0.538886 0.334372 0.308285 H\n0.901627 0.253959 0.393145 H\n0.666907 0.896358 0.515377 O\n0.758279 0.649504 0.717071 O\n0.156705 0.496129 0.920989 O\n0.525892 0.272194 0.180867 O\n0.438556 0.601031 0.636616 O\n0.146182 0.655365 0.580752 O\n0.861303 0.694002 0.515875 O\n0.361303 0.305998 0.984125 O\n0.646182 0.344635 0.919248 O\n0.938556 0.398969 0.863384 O\n0.961512 0.034290 0.359745 O\n0.187201 0.987080 0.306221 O\n0.656705 0.503871 0.579011 O\n0.014053 0.098089 0.142739 O\n0.258279 0.350496 0.782929 O\n0.514053 0.901911 0.357261 O\n0.687201 0.012920 0.193779 O\n0.166907 0.103642 0.984623 O\n0.461512 0.965710 0.140255 O\n0.974108 0.272194 0.680867 O\n0.025892 0.727806 0.319133 O\n0.538488 0.034290 0.859745 O\n0.833093 0.896358 0.015377 O\n0.312799 0.987080 0.806221 O\n0.485947 0.098089 0.642739 O\n0.741721 0.649504 0.217071 O\n0.985947 0.901911 0.857261 O\n0.343295 0.496129 0.420989 O\n0.812799 0.012920 0.693779 O\n0.038488 0.965710 0.640255 O\n0.061444 0.601031 0.136616 O\n0.353818 0.655365 0.080752 O\n0.638697 0.694002 0.015875 O\n0.138697 0.305998 0.484125 O\n0.853818 0.344635 0.419248 O\n0.561444 0.398969 0.363384 O\n0.474108 0.727806 0.819133 O\n0.843295 0.503871 0.079011 O\n0.241721 0.350496 0.282929 O\n0.333093 0.103642 0.484623 O\n",
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{
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{
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"structure_string": "Na3 Ca1 Fe4 Si8 O24\n1.0\n4.467609 6.119502 0.000000\n-4.467609 6.119502 0.000000\n0.000000 5.385229 8.245671\nNa Ca Fe Si O\n3 1 4 8 24\ndirect\n0.923748 0.076252 0.000000 Na\n0.077188 0.424979 0.248083 Na\n0.575021 0.922812 0.751917 Na\n0.424873 0.575127 0.500000 Ca\n0.022974 0.977026 0.500000 Fe\n0.523818 0.476182 0.000000 Fe\n0.476944 0.030254 0.243967 Fe\n0.969746 0.523056 0.756033 Fe\n0.721724 0.290021 0.705978 Si\n0.221380 0.792077 0.202521 Si\n0.709979 0.278276 0.294022 Si\n0.207923 0.778620 0.797479 Si\n0.776822 0.707893 0.046965 Si\n0.277264 0.204692 0.546305 Si\n0.795308 0.722736 0.453695 Si\n0.292107 0.223178 0.953035 Si\n0.754815 0.346862 0.833545 O\n0.258416 0.841114 0.334796 O\n0.653138 0.245185 0.166455 O\n0.158886 0.741584 0.665204 O\n0.735074 0.648831 0.923322 O\n0.237858 0.147382 0.420716 O\n0.852618 0.762142 0.579284 O\n0.351169 0.264926 0.076678 O\n0.752697 0.485273 0.532215 O\n0.257293 0.985726 0.031097 O\n0.514727 0.247303 0.467785 O\n0.014274 0.742707 0.968903 O\n0.740586 0.516699 0.224876 O\n0.245237 0.015090 0.720663 O\n0.984910 0.754763 0.279337 O\n0.483301 0.259414 0.775124 O\n0.851074 0.093932 0.666648 O\n0.350668 0.593462 0.167591 O\n0.906068 0.148926 0.333352 O\n0.406538 0.649332 0.832409 O\n0.649708 0.905832 0.080862 O\n0.157884 0.407930 0.578047 O\n0.592070 0.842116 0.421953 O\n0.094168 0.350292 0.919138 O\n",
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