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{
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{
"id": "mp-774896",
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"formula_full": "Li4 Nb3 Co3 Sn2 O16",
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"spacegroup": 8
},
{
"id": "mp-695911",
"created_at": "2022-09-04T14:43:13.130694Z",
"structure_string": "Mn4 Tl4 H8 O4 F16\n1.0\n3.364173 6.922866 0.000000\n-3.364173 6.922866 0.000000\n0.000000 2.487282 10.462898\nMn Tl H O F\n4 4 8 4 16\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.242890 0.757110 0.250000 Mn\n0.757110 0.242890 0.750000 Mn\n0.655363 0.179720 0.437036 Tl\n0.820280 0.344637 0.062964 Tl\n0.344637 0.820280 0.562964 Tl\n0.179720 0.655363 0.937036 Tl\n0.087821 0.272684 0.295694 H\n0.727316 0.912179 0.204306 H\n0.912179 0.727316 0.704306 H\n0.272684 0.087821 0.795694 H\n0.174574 0.416349 0.247325 H\n0.583651 0.825426 0.252675 H\n0.825426 0.583651 0.752675 H\n0.416349 0.174574 0.747325 H\n0.049889 0.420832 0.298315 O\n0.579168 0.950111 0.201685 O\n0.950111 0.579168 0.701685 O\n0.420832 0.049889 0.798315 O\n0.148082 0.637105 0.437348 F\n0.362895 0.851918 0.062652 F\n0.851918 0.362895 0.562652 F\n0.637105 0.148082 0.937348 F\n0.727760 0.773212 0.466714 F\n0.226788 0.272240 0.033286 F\n0.272240 0.226788 0.533286 F\n0.773212 0.727760 0.966714 F\n0.974036 0.884134 0.184917 F\n0.115866 0.025964 0.315083 F\n0.025964 0.115866 0.815083 F\n0.884134 0.974036 0.684917 F\n0.366899 0.486179 0.188725 F\n0.513821 0.633101 0.311275 F\n0.633101 0.513821 0.811275 F\n0.486179 0.366899 0.688725 F\n",
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"density": 4.8155252113889775,
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"formula_full": "Mn4 Tl4 H8 O4 F16",
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"updated_at": "2021-11-28T01:36:00.618000Z",
"spacegroup": 15
},
{
"id": "mp-755086",
"created_at": "2022-09-04T14:43:13.131226Z",
"structure_string": "Ta4 Cr2 N2 O10\n1.0\n4.772607 -0.009935 -0.011330\n-0.009935 4.772607 0.011332\n-0.022142 0.022145 9.217647\nTa Cr N O\n4 2 2 10\ndirect\n0.008442 0.991558 0.326200 Ta\n0.991558 0.008442 0.673800 Ta\n0.485613 0.514388 0.168675 Ta\n0.514387 0.485613 0.831325 Ta\n0.500005 0.499996 0.500000 Cr\n0.999999 0.999997 0.999998 Cr\n0.198771 0.801229 0.169192 N\n0.801228 0.198772 0.830808 N\n0.194858 0.805142 0.497858 O\n0.805141 0.194859 0.502142 O\n0.196143 0.803857 0.829196 O\n0.803856 0.196144 0.170804 O\n0.307848 0.307849 0.000000 O\n0.692152 0.692153 0.000000 O\n0.307278 0.300771 0.332504 O\n0.300770 0.307279 0.667496 O\n0.699229 0.692722 0.332504 O\n0.692721 0.699230 0.667496 O\n",
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],
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"formula_full": "Ta4 Cr2 N2 O10",
"formula_reduced": "Ta2CrNO5",
"formula_anonymous": "ABC2D5",
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},
{
"id": "mp-1221326",
"created_at": "2022-09-04T14:43:13.141546Z",
"structure_string": "Na2 Pr1 O3\n1.0\n-1.800548 2.387476 5.261795\n1.800548 -2.387476 5.261795\n1.800548 2.387476 -5.261795\nNa Pr O\n2 1 3\ndirect\n0.671266 0.671266 0.000000 Na\n0.328734 0.328734 0.000000 Na\n0.000000 0.000000 0.000000 Pr\n0.500000 0.000000 0.500000 O\n0.150322 0.650322 0.500000 O\n0.849678 0.349678 0.500000 O\n",
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"spacegroup": 71
},
{
"id": "mp-971928",
"created_at": "2022-09-04T14:43:13.143874Z",
"structure_string": "Zn3 Ge1\n1.0\n-1.993779 1.993779 4.089065\n1.993779 -1.993779 4.089065\n1.993779 1.993779 -4.089065\nZn Ge\n3 1\ndirect\n0.750000 0.250000 0.500000 Zn\n0.250000 0.750000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.000000 Ge\n",
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{
"id": "mp-1244922",
"created_at": "2022-09-04T14:43:13.155226Z",
"structure_string": "Zn50 S50\n1.0\n14.399522 -0.346912 0.648693\n-0.318847 12.690626 0.032818\n0.586799 0.005081 13.132324\nZn S\n50 50\ndirect\n0.871845 0.604946 0.005379 Zn\n0.359298 0.116877 0.138032 Zn\n0.465570 0.959630 0.817124 Zn\n0.074275 0.842904 0.994783 Zn\n0.334856 0.065330 0.684782 Zn\n0.620314 0.647135 0.959670 Zn\n0.697191 0.982684 0.187102 Zn\n0.515307 0.470923 0.331078 Zn\n0.796288 0.687203 0.704342 Zn\n0.300336 0.809732 0.004102 Zn\n0.503035 0.108841 0.370868 Zn\n0.814295 0.189287 0.991163 Zn\n0.229766 0.412810 0.674465 Zn\n0.755615 0.544331 0.300705 Zn\n0.748223 0.390937 0.816455 Zn\n0.481629 0.284546 0.859807 Zn\n0.408699 0.350053 0.147306 Zn\n0.670829 0.092676 0.752029 Zn\n0.930790 0.088723 0.070379 Zn\n0.546047 0.107033 0.062121 Zn\n0.218548 0.008050 0.464034 Zn\n0.015081 0.886673 0.518185 Zn\n0.641136 0.624114 0.142217 Zn\n0.995522 0.012972 0.283201 Zn\n0.517703 0.664244 0.468272 Zn\n0.991013 0.125910 0.524701 Zn\n0.942597 0.096773 0.874005 Zn\n0.853602 0.395860 0.540093 Zn\n0.062891 0.634057 0.660493 Zn\n0.188709 0.134535 0.727888 Zn\n0.106730 0.400719 0.483773 Zn\n0.570166 0.247940 0.612005 Zn\n0.937712 0.738165 0.201841 Zn\n0.148017 0.192302 0.196568 Zn\n0.631534 0.631516 0.648260 Zn\n0.449891 0.960906 0.174915 Zn\n0.475684 0.665405 0.110511 Zn\n0.120979 0.763867 0.287689 Zn\n0.241085 0.664344 0.443201 Zn\n0.316002 0.242950 0.408264 Zn\n0.157152 0.628244 0.891057 Zn\n0.399825 0.862430 0.561645 Zn\n0.001842 0.349103 0.840684 Zn\n0.019416 0.829751 0.756006 Zn\n0.691186 0.823732 0.655190 Zn\n0.806242 0.858484 0.963264 Zn\n0.874068 0.187429 0.736130 Zn\n0.385840 0.531850 0.854399 Zn\n0.219507 0.309374 0.921651 Zn\n0.941694 0.578969 0.311768 Zn\n0.552830 0.942545 0.956947 S\n0.377474 0.039425 0.499569 S\n0.511967 0.275273 0.025798 S\n0.551449 0.577589 0.809328 S\n0.456599 0.278849 0.314755 S\n0.918351 0.993549 0.437493 S\n0.353474 0.885677 0.734223 S\n0.098996 0.031659 0.603392 S\n0.991922 0.174214 0.206201 S\n0.418419 0.516978 0.210905 S\n0.351778 0.362028 0.806310 S\n0.145323 0.450690 0.837232 S\n0.152300 0.744573 0.756910 S\n0.598244 0.443374 0.882959 S\n0.157151 0.830002 0.442602 S\n0.854885 0.358087 0.932624 S\n0.055205 0.878432 0.187031 S\n0.511215 0.137196 0.754679 S\n0.695261 0.145128 0.112895 S\n0.975949 0.296472 0.574218 S\n0.175340 0.546103 0.565059 S\n0.091064 0.198174 0.863743 S\n0.237604 0.114887 0.310109 S\n0.218116 0.287456 0.544143 S\n0.266493 0.263225 0.085927 S\n0.961585 0.508418 0.749735 S\n0.381042 0.800975 0.145675 S\n0.942749 0.751678 0.623378 S\n0.301416 0.629207 0.963557 S\n0.485773 0.394593 0.608084 S\n0.387238 0.742212 0.430825 S\n0.021921 0.662252 0.027398 S\n0.559995 0.956653 0.290378 S\n0.820460 0.882899 0.135857 S\n0.187133 0.598399 0.283991 S\n0.737220 0.994519 0.611463 S\n0.957360 0.914568 0.893453 S\n0.764522 0.519416 0.123137 S\n0.078041 0.484075 0.322537 S\n0.628942 0.644573 0.318692 S\n0.776926 0.689401 0.894101 S\n0.544132 0.773020 0.610561 S\n0.631956 0.158518 0.469637 S\n0.211701 0.935709 0.962952 S\n0.832445 0.506351 0.688174 S\n0.624469 0.003485 0.521407 S\n0.683075 0.952467 0.870820 S\n0.730988 0.260453 0.692458 S\n0.569667 0.487008 0.501242 S\n0.840800 0.428222 0.373956 S\n",
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{
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{
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