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{
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"structure_string": "Zn1 H4 C4 O4\n1.0\n3.454606 -0.070306 -0.467428\n-1.372677 4.253262 0.573060\n-0.258148 0.046116 7.590546\nZn H C O\n1 4 4 4\ndirect\n0.611696 0.160263 0.268297 Zn\n0.509651 0.864682 0.689630 H\n0.105605 -0.000945 0.694459 H\n0.118470 0.321381 0.842178 H\n0.714363 0.455696 0.846970 H\n0.987041 0.665702 0.506188 C\n0.175638 0.781295 0.688940 C\n0.048379 0.539125 0.847677 C\n0.236866 0.654742 0.030429 C\n0.026075 0.871983 0.369000 O\n0.800290 0.371572 0.497171 O\n0.197714 0.448473 0.167628 O\n0.423598 0.948874 0.039443 O\n",
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{
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"structure_string": "Na2 Ti3 Cl8\n1.0\n6.463101 0.078462 4.412135\n2.371381 6.012851 4.412135\n0.113796 0.078462 7.824684\nNa Ti Cl\n2 3 8\ndirect\n0.162202 0.162202 0.162201 Na\n0.837799 0.837798 0.837797 Na\n0.500000 0.500000 -0.000000 Ti\n0.000000 0.500000 0.499999 Ti\n0.500000 -0.000000 0.499999 Ti\n0.407287 0.407286 0.407286 Cl\n0.592714 0.592713 0.592713 Cl\n0.097071 0.584427 0.097070 Cl\n0.097071 0.097071 0.584427 Cl\n0.584427 0.097071 0.097070 Cl\n0.415573 0.902929 0.902928 Cl\n0.902930 0.415572 0.902928 Cl\n0.902929 0.902929 0.415572 Cl\n",
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{
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"structure_string": "Mg1 Mn4 S8\n1.0\n6.878561 0.006076 0.004296\n3.444542 5.966120 0.000000\n3.444542 1.988707 5.624914\nMg Mn S\n1 4 8\ndirect\n0.500000 0.000000 0.000000 Mg\n-0.000000 0.500000 0.500000 Mn\n0.499999 0.500000 0.000000 Mn\n0.499999 0.500001 0.500000 Mn\n0.499999 0.000001 0.500000 Mn\n0.259321 0.256848 0.256848 S\n0.259320 0.256849 0.726984 S\n0.259321 0.726984 0.256848 S\n0.727599 0.257467 0.257467 S\n0.272400 0.742534 0.742533 S\n0.740678 0.743153 0.273016 S\n0.740678 0.273017 0.743152 S\n0.740678 0.743153 0.743152 S\n",
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{
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"updated_at": "2022-09-04T14:36:42.342355Z",
"structure_string": "Zn1 H4 C4 O4\n1.0\n5.061003 0.003169 0.001490\n2.527215 3.736602 1.776484\n-0.001419 -0.126348 6.556576\nZn H C O\n1 4 4 4\ndirect\n0.811078 0.859996 0.285677 Zn\n0.050839 0.244188 0.769207 H\n0.935563 0.101611 0.595739 H\n0.435195 0.475709 0.802167 H\n0.177263 0.618130 0.975625 H\n0.337105 0.120829 0.533854 C\n0.144141 0.049470 0.695781 C\n0.333673 0.670415 0.875598 C\n0.597865 0.599190 0.037534 C\n0.247542 0.436408 0.403511 O\n0.594084 0.850198 0.533845 O\n0.823928 0.283649 0.167815 O\n0.584061 0.869892 0.037607 O\n",
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{
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"updated_at": "2022-09-04T14:36:32.917170Z",
"structure_string": "Zn1 Fe4 S8\n1.0\n5.727460 -0.094263 4.219156\n2.080288 5.337143 4.219156\n-0.140376 -0.094263 7.112340\nZn Fe S\n1 4 8\ndirect\n0.500000 0.500001 0.500000 Zn\n0.500001 0.999999 0.500002 Fe\n0.999999 0.500001 0.500002 Fe\n0.500000 0.500000 0.000001 Fe\n0.000000 0.000000 0.000000 Fe\n0.758132 0.267286 0.758133 S\n0.241866 0.241868 0.732715 S\n0.241867 0.732715 0.241867 S\n0.732713 0.241868 0.241868 S\n0.261165 0.261167 0.261166 S\n0.738834 0.738835 0.738835 S\n0.267286 0.758134 0.758133 S\n0.758133 0.758134 0.267287 S\n",
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{
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"structure_string": "Zr1 H4 C4 O4\n1.0\n3.422021 -0.066534 -0.209332\n-1.153207 5.612814 -2.377224\n0.003983 -0.089259 6.886966\nZr H C O\n1 4 4 4\ndirect\n0.124095 0.151728 0.994168 Zr\n0.381659 0.649836 0.025227 H\n0.909167 0.479425 0.388860 H\n0.662141 0.252873 0.920191 H\n0.403820 0.658979 0.263068 H\n0.307910 0.224610 0.517233 C\n0.781825 0.291641 0.278146 C\n0.657465 0.855129 0.731536 C\n0.455783 0.179574 0.338365 C\n0.159031 0.234611 0.670879 O\n0.480899 0.739932 0.548296 O\n0.494303 0.854271 0.907945 O\n0.288295 0.559988 0.111503 O\n",
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"structure_string": "V1 H6 O3 F3\n1.0\n5.199402 3.335241 2.778697\n-4.780395 3.437892 0.851375\n0.823197 -6.547120 1.492183\nV H O F\n1 6 3 3\ndirect\n0.680632 0.821341 0.934852 V\n0.846663 0.112144 0.637532 H\n0.183794 0.959675 0.897091 H\n0.180573 0.777184 0.350697 H\n0.263067 0.715053 0.352476 H\n0.947056 0.294571 0.721037 H\n0.090027 0.807834 0.716045 H\n0.581266 0.644287 0.558600 O\n0.583138 0.407077 0.562380 O\n0.435031 0.707154 0.982879 O\n0.517578 0.503876 -0.009330 F\n0.004234 0.059194 0.239137 F\n0.701145 0.204820 0.070813 F\n",
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"structure_string": "Ta4 Ga1 Se8\n1.0\n6.418852 -0.000000 3.705926\n2.139618 6.051752 3.705926\n0.000000 0.000000 7.411853\nTa Ga Se\n4 1 8\ndirect\n0.602282 0.602281 0.602282 Ta\n0.602282 0.193156 0.602282 Ta\n0.193156 0.602281 0.602282 Ta\n0.602282 0.602281 0.193157 Ta\n0.000000 0.000000 0.000000 Ga\n0.864504 0.406488 0.864505 Se\n0.364037 0.364037 0.364037 Se\n0.364037 0.364037 0.907891 Se\n0.907891 0.364037 0.364037 Se\n0.864504 0.864504 0.406489 Se\n0.864504 0.864504 0.864505 Se\n0.406488 0.864504 0.864505 Se\n0.364037 0.907890 0.364037 Se\n",
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"structure_string": "Sr2 Y1 Tl1 Fe2 O7\n1.0\n3.825638 0.000000 -0.000000\n0.000000 3.825638 -0.000000\n0.000000 -0.000000 12.547794\nSr Y Tl Fe O\n2 1 1 2 7\ndirect\n0.500000 0.500000 0.198548 Sr\n0.500000 0.500000 0.801414 Sr\n0.500000 0.500000 0.500004 Y\n0.000000 0.000000 0.999982 Tl\n0.000000 0.000000 0.359161 Fe\n0.000000 0.000000 0.640845 Fe\n0.000000 0.500000 0.385770 O\n0.500000 0.000000 0.385770 O\n0.000000 0.500000 0.614258 O\n0.500000 0.000000 0.614258 O\n0.000000 0.000000 0.205476 O\n0.000000 0.000000 0.794533 O\n0.500000 0.500000 0.999983 O\n",
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}