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{
"id": "mp-1223769",
"created_at": "2022-09-04T14:39:20.271987Z",
"structure_string": "K4 Ta3 Nb1 O12\n1.0\n9.459361 -2.852062 0.000000\n9.459361 2.852062 0.000000\n8.599444 0.000000 4.864496\nK Ta Nb O\n4 3 1 12\ndirect\n0.375014 0.375014 0.375014 K\n0.125014 0.125014 0.125014 K\n0.874986 0.874986 0.874986 K\n0.624986 0.624986 0.624986 K\n0.250185 0.250185 0.250185 Ta\n0.000000 0.000000 0.000000 Ta\n0.749815 0.749815 0.749815 Ta\n0.500000 0.500000 0.500000 Nb\n0.124929 0.625206 0.124929 O\n0.875071 0.374794 0.875071 O\n0.625555 0.123344 0.625555 O\n0.374445 0.876656 0.374445 O\n0.875071 0.875071 0.374794 O\n0.625555 0.625555 0.123344 O\n0.374445 0.374445 0.876656 O\n0.124929 0.124929 0.625206 O\n0.374794 0.875071 0.875071 O\n0.123344 0.625555 0.625555 O\n0.876656 0.374445 0.374445 O\n0.625206 0.124929 0.124929 O\n",
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{
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{
"id": "mp-1208989",
"created_at": "2022-09-04T14:39:29.338636Z",
"structure_string": "U4 H20 Se8 O40\n1.0\n8.190261 0.000000 0.000000\n0.000000 11.897350 0.000000\n0.000000 0.000000 12.608091\nU H Se O\n4 20 8 40\ndirect\n0.806627 0.750000 0.753146 U\n0.193373 0.250000 0.246854 U\n0.306627 0.250000 0.746854 U\n0.693373 0.750000 0.253146 U\n0.125828 0.750000 0.529581 H\n0.874172 0.250000 0.470419 H\n0.625828 0.250000 0.970419 H\n0.374172 0.750000 0.029581 H\n0.263083 0.750000 0.810234 H\n0.736917 0.250000 0.189766 H\n0.763083 0.250000 0.689766 H\n0.236917 0.750000 0.310234 H\n0.020321 0.750000 0.069639 H\n0.979679 0.250000 0.930361 H\n0.520321 0.250000 0.430361 H\n0.479679 0.750000 0.569639 H\n0.841354 0.472763 0.479741 H\n0.158646 0.527237 0.520259 H\n0.341354 0.527237 0.020259 H\n0.158646 0.972763 0.520259 H\n0.658646 0.472763 0.979741 H\n0.841354 0.027237 0.479741 H\n0.658646 0.027237 0.979741 H\n0.341354 0.972763 0.020259 H\n0.524320 0.512024 0.823051 Se\n0.475680 0.487976 0.176949 Se\n0.024320 0.487976 0.676949 Se\n0.475680 0.012024 0.176949 Se\n0.975680 0.512024 0.323050 Se\n0.524320 0.987976 0.823051 Se\n0.975680 0.987976 0.323050 Se\n0.024320 0.012024 0.676949 Se\n0.800534 0.750000 0.894919 O\n0.199466 0.250000 0.105081 O\n0.300534 0.250000 0.605081 O\n0.699466 0.750000 0.394919 O\n0.863158 0.042054 0.604640 O\n0.136842 0.957946 0.395360 O\n0.363158 0.957946 0.895360 O\n0.136842 0.542054 0.395360 O\n0.636842 0.042054 0.104640 O\n0.863158 0.457946 0.604640 O\n0.636842 0.457946 0.104640 O\n0.363158 0.542054 0.895360 O\n0.192940 0.518828 0.598058 O\n0.807060 0.481172 0.401942 O\n0.692940 0.481172 0.901942 O\n0.807060 0.018828 0.401942 O\n0.307060 0.518828 0.098058 O\n0.192940 0.981172 0.598058 O\n0.307060 0.981172 0.098058 O\n0.692940 0.018828 0.901942 O\n0.591830 0.616629 0.746520 O\n0.408170 0.383371 0.253480 O\n0.091830 0.383371 0.753480 O\n0.408170 0.116629 0.253480 O\n0.908170 0.616629 0.246520 O\n0.591830 0.883371 0.746520 O\n0.908170 0.883371 0.246520 O\n0.091830 0.116629 0.753480 O\n0.826326 0.750000 0.611884 O\n0.173674 0.250000 0.388116 O\n0.326326 0.250000 0.888116 O\n0.673674 0.750000 0.111884 O\n0.991410 0.597052 0.758166 O\n0.008590 0.402948 0.241834 O\n0.491410 0.402948 0.741834 O\n0.008590 0.097052 0.241834 O\n0.508590 0.597052 0.258166 O\n0.991410 0.902948 0.758166 O\n0.508590 0.902948 0.258166 O\n0.491410 0.097052 0.741834 O\n",
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"formula_full": "U4 H20 Se8 O40",
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"spacegroup": 62
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{
"id": "mp-1101562",
"created_at": "2022-09-04T14:39:41.860783Z",
"structure_string": "Cr2 P10 O30\n1.0\n12.187372 0.000000 -0.598765\n0.000000 10.452572 0.000000\n0.088299 0.000000 5.031910\nCr P O\n2 10 30\ndirect\n0.997122 0.001752 0.003811 Cr\n0.497122 0.998248 0.503812 Cr\n0.747080 0.988329 0.754714 P\n0.848521 0.557879 0.436281 P\n0.080529 0.166673 0.516840 P\n0.152010 0.443021 0.566406 P\n0.247080 0.011671 0.254715 P\n0.348522 0.442121 0.936282 P\n0.414995 0.164577 0.991590 P\n0.580529 0.833327 0.016839 P\n0.652010 0.556979 0.066406 P\n0.914995 0.835423 0.491590 P\n0.692038 0.479730 0.807821 O\n0.998603 0.887060 0.688651 O\n0.996554 0.116551 0.318828 O\n0.055778 0.154276 0.805942 O\n0.078237 0.527007 0.708409 O\n0.104411 0.313099 0.444108 O\n0.192038 0.520270 0.307821 O\n0.152942 0.942764 0.118784 O\n0.199778 0.106616 0.475468 O\n0.250272 0.385754 0.750800 O\n0.294710 0.108822 0.038234 O\n0.340891 0.940762 0.387389 O\n0.308383 0.520825 0.192751 O\n0.394709 0.312087 0.061196 O\n0.438268 0.150168 0.702088 O\n0.423413 0.524789 0.794558 O\n0.496554 0.883449 0.818827 O\n0.498603 0.112940 0.188653 O\n0.555778 0.845724 0.305943 O\n0.938267 0.849832 0.202089 O\n0.604412 0.686901 0.944109 O\n0.923412 0.475211 0.294557 O\n0.652942 0.057236 0.618784 O\n0.699778 0.893384 0.975468 O\n0.750272 0.614246 0.250801 O\n0.794709 0.891178 0.538235 O\n0.840891 0.059238 0.887388 O\n0.808383 0.479175 0.692751 O\n0.894709 0.687913 0.561196 O\n0.578237 0.472992 0.208408 O\n",
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{
"id": "mp-1213268",
"created_at": "2022-09-04T14:39:28.735158Z",
"structure_string": "Cs4 Lu8 Cl28\n1.0\n6.962723 0.000000 0.000000\n0.000000 12.599084 0.000000\n0.000000 0.000000 13.501506\nCs Lu Cl\n4 8 28\ndirect\n0.250000 0.804178 0.042896 Cs\n0.750000 0.195822 0.957104 Cs\n0.750000 0.304178 0.457104 Cs\n0.250000 0.695822 0.542896 Cs\n0.250000 0.459462 0.237614 Lu\n0.750000 0.540538 0.762386 Lu\n0.750000 0.959462 0.262386 Lu\n0.250000 0.040538 0.737614 Lu\n0.250000 0.157657 0.250783 Lu\n0.750000 0.842343 0.749217 Lu\n0.750000 0.657657 0.249217 Lu\n0.250000 0.342343 0.750783 Lu\n0.013643 0.306712 0.176831 Cl\n0.986357 0.693288 0.823169 Cl\n0.986357 0.806712 0.323169 Cl\n0.513643 0.693288 0.823169 Cl\n0.013643 0.193288 0.676831 Cl\n0.486357 0.306712 0.176831 Cl\n0.486357 0.193288 0.676831 Cl\n0.513643 0.806712 0.323169 Cl\n0.007353 0.575014 0.124514 Cl\n0.992647 0.424986 0.875486 Cl\n0.992647 0.075014 0.375486 Cl\n0.507353 0.424986 0.875486 Cl\n0.007353 0.924986 0.624514 Cl\n0.492647 0.575014 0.124514 Cl\n0.492647 0.924986 0.624514 Cl\n0.507353 0.075014 0.375486 Cl\n0.010327 0.040062 0.136589 Cl\n0.989673 0.959938 0.863411 Cl\n0.989673 0.540062 0.363411 Cl\n0.510327 0.959938 0.863411 Cl\n0.010327 0.459938 0.636589 Cl\n0.489673 0.040062 0.136589 Cl\n0.489673 0.459938 0.636589 Cl\n0.510327 0.540062 0.363411 Cl\n0.250000 0.311558 0.389536 Cl\n0.750000 0.688442 0.610464 Cl\n0.750000 0.811558 0.110464 Cl\n0.250000 0.188442 0.889536 Cl\n",
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{
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"structure_string": "Pr2 Dy6\n1.0\n3.638335 -6.301782 0.000000\n3.638335 6.301782 0.000000\n0.000000 0.000000 5.804780\nPr Dy\n2 6\ndirect\n0.333333 0.666667 0.750000 Pr\n0.666667 0.333333 0.250000 Pr\n0.165023 0.330045 0.250000 Dy\n0.669955 0.834977 0.250000 Dy\n0.165023 0.834977 0.250000 Dy\n0.834977 0.669955 0.750000 Dy\n0.330045 0.165023 0.750000 Dy\n0.834977 0.165023 0.750000 Dy\n",
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{
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"structure_string": "Rb4 Ba4 P4 S16\n1.0\n6.832527 0.000000 0.000000\n0.000000 10.214272 0.000000\n0.000000 0.000000 11.727656\nRb Ba P S\n4 4 4 16\ndirect\n0.250000 0.845798 0.915712 Rb\n0.250000 0.654202 0.415712 Rb\n0.750000 0.154202 0.084288 Rb\n0.750000 0.345798 0.584288 Rb\n0.250000 0.394441 0.851034 Ba\n0.250000 0.105559 0.351034 Ba\n0.750000 0.605559 0.148966 Ba\n0.750000 0.894441 0.648966 Ba\n0.250000 0.107364 0.684072 P\n0.250000 0.392636 0.184072 P\n0.750000 0.892636 0.315928 P\n0.750000 0.607364 0.815928 P\n0.494464 0.115392 0.784126 S\n0.005536 0.384608 0.284126 S\n0.994464 0.884608 0.215874 S\n0.505536 0.615392 0.715874 S\n0.505536 0.884608 0.215874 S\n0.994464 0.615392 0.715874 S\n0.005536 0.115392 0.784126 S\n0.494464 0.384608 0.284126 S\n0.250000 0.271405 0.581514 S\n0.250000 0.228595 0.081514 S\n0.750000 0.728595 0.418486 S\n0.750000 0.771405 0.918486 S\n0.250000 0.936295 0.590230 S\n0.250000 0.563705 0.090230 S\n0.750000 0.063705 0.409770 S\n0.750000 0.436295 0.909770 S\n",
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{
"id": "mp-1344128",
"created_at": "2022-09-04T14:39:33.832541Z",
"structure_string": "Li6 Mn2 O1 F11\n1.0\n5.085687 0.000000 0.000000\n-2.515588 4.923272 0.000000\n0.000602 -2.965028 8.249148\nLi Mn O F\n6 2 1 11\ndirect\n0.205331 0.344277 0.064728 Li\n0.052396 0.404103 0.693746 Li\n0.971146 0.604879 0.328245 Li\n0.265540 0.144419 0.402925 Li\n0.755771 0.610782 0.938864 Li\n0.460134 0.127852 0.830021 Li\n0.735691 0.900615 0.567762 Mn\n0.517937 0.858517 0.180018 Mn\n0.787462 0.870308 0.378848 O\n0.284925 0.021374 0.223295 F\n0.778661 0.571167 0.692113 F\n0.687873 0.634826 0.136656 F\n0.712424 0.250720 0.473303 F\n0.242357 0.788992 0.982900 F\n0.318723 0.725682 0.534449 F\n0.777292 0.215044 0.028550 F\n0.330296 0.377773 0.873579 F\n0.151924 0.101633 0.614014 F\n0.214483 0.470467 0.281265 F\n0.722702 0.970995 0.765460 F\n",
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