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{
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{
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"formula_full": "Na8 Fe4 C8 S2 O32",
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{
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{
"id": "mp-1193153",
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"structure_string": "Na2 Al2 Cr4 O20\n1.0\n2.715070 7.120586 0.000000\n-2.715070 7.120586 0.000000\n0.000000 3.807753 10.230110\nNa Al Cr O\n2 2 4 20\ndirect\n0.784352 0.215648 0.250000 Na\n0.215648 0.784352 0.750000 Na\n0.000000 0.500000 0.000000 Al\n0.500000 0.000000 0.500000 Al\n0.360305 0.839730 0.038582 Cr\n0.160270 0.639695 0.461418 Cr\n0.639695 0.160270 0.961418 Cr\n0.839730 0.360305 0.538582 Cr\n0.148962 0.177875 0.569838 O\n0.822125 0.851038 0.930162 O\n0.851038 0.822125 0.430162 O\n0.177875 0.148962 0.069838 O\n0.679295 0.602852 0.079104 O\n0.397148 0.320705 0.420896 O\n0.320705 0.397148 0.920896 O\n0.602852 0.679295 0.579104 O\n0.847932 0.374910 0.385289 O\n0.625090 0.152068 0.114711 O\n0.152068 0.625090 0.614711 O\n0.374910 0.847932 0.885289 O\n0.210517 0.755148 0.125960 O\n0.244852 0.789483 0.374040 O\n0.789483 0.244852 0.874040 O\n0.755148 0.210517 0.625960 O\n0.012352 0.547831 0.157486 O\n0.452169 0.987648 0.342514 O\n0.987648 0.452169 0.842514 O\n0.547831 0.012352 0.657486 O\n",
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{
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"structure_string": "Cr8 Hg4 N8 Cl8 O28\n1.0\n8.114357 0.000000 0.000000\n0.000000 10.275300 0.000000\n0.000000 1.833664 15.579273\nCr Hg N Cl O\n8 4 8 8 28\ndirect\n0.123925 0.216521 0.526218 Cr\n0.623925 0.783479 0.973782 Cr\n0.876075 0.783479 0.473782 Cr\n0.376075 0.216521 0.026218 Cr\n0.188139 0.475921 0.620876 Cr\n0.688139 0.524079 0.879124 Cr\n0.811861 0.524079 0.379124 Cr\n0.311861 0.475921 0.120876 Cr\n0.387127 0.838808 0.561575 Hg\n0.887127 0.161192 0.938425 Hg\n0.612873 0.161192 0.438425 Hg\n0.112873 0.838808 0.061575 Hg\n0.189401 0.535199 0.863083 N\n0.689401 0.464801 0.636917 N\n0.810599 0.464801 0.136917 N\n0.310599 0.535199 0.363083 N\n0.397388 0.119725 0.791071 N\n0.897388 0.880275 0.708929 N\n0.602612 0.880275 0.208929 N\n0.102612 0.119725 0.291071 N\n0.123660 0.886949 0.913034 Cl\n0.623660 0.113051 0.586966 Cl\n0.876340 0.113051 0.086966 Cl\n0.376340 0.886949 0.413034 Cl\n0.395825 0.804341 0.709872 Cl\n0.895825 0.195659 0.790128 Cl\n0.604175 0.195659 0.290128 Cl\n0.104175 0.804341 0.209872 Cl\n0.068171 0.365893 0.566055 O\n0.568171 0.634107 0.933945 O\n0.931829 0.634107 0.433945 O\n0.431829 0.365893 0.066055 O\n0.220368 0.240721 0.959840 O\n0.720368 0.759279 0.540160 O\n0.779632 0.759279 0.040160 O\n0.279632 0.240721 0.459840 O\n0.178289 0.106352 0.604138 O\n0.678289 0.893648 0.895862 O\n0.821711 0.893648 0.395862 O\n0.321711 0.106352 0.104138 O\n0.032410 0.840271 0.525683 O\n0.532410 0.159729 0.974317 O\n0.967590 0.159729 0.474317 O\n0.467590 0.840271 0.025683 O\n0.315105 0.563331 0.555179 O\n0.815105 0.436669 0.944821 O\n0.684895 0.436669 0.444821 O\n0.184895 0.563331 0.055179 O\n0.069662 0.578601 0.664456 O\n0.569662 0.421399 0.835544 O\n0.930338 0.421399 0.335544 O\n0.430338 0.578601 0.164456 O\n0.296966 0.394074 0.695971 O\n0.796966 0.605926 0.804029 O\n0.703034 0.605926 0.304029 O\n0.203034 0.394074 0.195971 O\n",
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{
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"structure_string": "Li8 Fe8 P8 H16 O40\n1.0\n5.087471 0.000000 0.000000\n0.000000 10.305617 0.000000\n0.000000 0.000000 16.896288\nLi Fe P H O\n8 8 8 16 40\ndirect\n0.470668 0.175585 0.495932 Li\n0.529332 0.175585 0.995932 Li\n0.911725 0.395695 0.247294 Li\n0.088275 0.395695 0.747294 Li\n0.470668 0.675585 0.004068 Li\n0.529332 0.675585 0.504068 Li\n0.088275 0.895695 0.752706 Li\n0.911725 0.895695 0.252706 Li\n0.457358 0.147054 0.688950 Fe\n0.542642 0.147054 0.188950 Fe\n0.113856 0.421511 0.942201 Fe\n0.886144 0.421511 0.442201 Fe\n0.542642 0.647054 0.311050 Fe\n0.457358 0.647054 0.811050 Fe\n0.113856 0.921511 0.557799 Fe\n0.886144 0.921511 0.057799 Fe\n0.014784 0.227606 0.091829 P\n0.985216 0.227606 0.591829 P\n0.410641 0.345028 0.340983 P\n0.589359 0.345028 0.840983 P\n0.014784 0.727606 0.408171 P\n0.985216 0.727606 0.908171 P\n0.589359 0.845028 0.659017 P\n0.410641 0.845028 0.159017 P\n0.091591 0.003124 0.371611 H\n0.908409 0.003124 0.871611 H\n0.636086 0.052057 0.380610 H\n0.363914 0.052057 0.880610 H\n0.134439 0.110719 0.307962 H\n0.865561 0.110719 0.807962 H\n0.623949 0.448598 0.053419 H\n0.376051 0.448598 0.553419 H\n0.091591 0.503124 0.128389 H\n0.908409 0.503124 0.628389 H\n0.363914 0.552057 0.619390 H\n0.636086 0.552057 0.119390 H\n0.865561 0.610719 0.692038 H\n0.134439 0.610719 0.192038 H\n0.623949 0.948598 0.446581 H\n0.376051 0.948598 0.946581 H\n0.529377 0.024908 0.426194 O\n0.470623 0.024908 0.926194 O\n0.013204 0.039623 0.323443 O\n0.986796 0.039623 0.823443 O\n0.860318 0.117795 0.047966 O\n0.139682 0.117795 0.547966 O\n0.312242 0.194117 0.094438 O\n0.687758 0.194117 0.594438 O\n0.578471 0.216679 0.794269 O\n0.421529 0.216679 0.294269 O\n0.897713 0.241518 0.176640 O\n0.102287 0.241518 0.676640 O\n0.465831 0.326034 0.924969 O\n0.534169 0.326034 0.424969 O\n0.969915 0.356096 0.046293 O\n0.030085 0.356096 0.546293 O\n0.120374 0.389334 0.347094 O\n0.879626 0.389334 0.847094 O\n0.575459 0.451330 0.297311 O\n0.424541 0.451330 0.797311 O\n0.470623 0.524908 0.573806 O\n0.529377 0.524908 0.073806 O\n0.986796 0.539623 0.676557 O\n0.013204 0.539623 0.176557 O\n0.139682 0.617795 0.952034 O\n0.860318 0.617795 0.452034 O\n0.687758 0.694117 0.905562 O\n0.312242 0.694117 0.405562 O\n0.421529 0.716679 0.205731 O\n0.578471 0.716679 0.705731 O\n0.102287 0.741518 0.823360 O\n0.897713 0.741518 0.323360 O\n0.465831 0.826034 0.575031 O\n0.534169 0.826034 0.075031 O\n0.969915 0.856096 0.453707 O\n0.030085 0.856096 0.953707 O\n0.879626 0.889334 0.652906 O\n0.120374 0.889334 0.152906 O\n0.424541 0.951330 0.702689 O\n0.575459 0.951330 0.202689 O\n",
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{
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