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{
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"spacegroup": 61
},
{
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"structure_string": "Sc3 In1 C1\n1.0\n4.558098 0.000000 0.000000\n0.000000 4.558098 0.000000\n0.000000 0.000000 4.558098\nSc In C\n3 1 1\ndirect\n0.500000 0.000000 0.500000 Sc\n0.000000 0.500000 0.500000 Sc\n0.500000 0.500000 0.000000 Sc\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 C\n",
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"spacegroup": 221
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{
"id": "mp-1111487",
"created_at": "2022-09-04T14:41:17.098572Z",
"structure_string": "Na3 Y1 Cl6\n1.0\n0.000000 5.318810 5.318810\n5.318810 0.000000 5.318810\n5.318810 5.318810 0.000000\nNa Y Cl\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Y\n0.753644 0.246356 0.246356 Cl\n0.246356 0.246356 0.753644 Cl\n0.246356 0.753644 0.753644 Cl\n0.246356 0.753644 0.246356 Cl\n0.753644 0.246356 0.753644 Cl\n0.753644 0.753644 0.246356 Cl\n",
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{
"id": "mp-569112",
"created_at": "2022-09-04T14:41:17.118689Z",
"structure_string": "Li6 Ca2 Mn2 N6\n1.0\n6.426277 -2.876441 0.000000\n6.426277 2.876441 0.000000\n5.138765 0.000000 4.812904\nLi Ca Mn N\n6 2 2 6\ndirect\n0.478720 0.894674 0.239972 Li\n0.894674 0.239972 0.478720 Li\n0.760028 0.521280 0.105326 Li\n0.521280 0.105326 0.760028 Li\n0.105326 0.760028 0.521280 Li\n0.239972 0.478720 0.894674 Li\n0.337402 0.337402 0.337402 Ca\n0.662598 0.662598 0.662598 Ca\n0.934965 0.934965 0.934965 Mn\n0.065035 0.065035 0.065035 Mn\n0.215978 0.908248 0.616820 N\n0.616820 0.215978 0.908248 N\n0.784022 0.091752 0.383180 N\n0.091752 0.383180 0.784022 N\n0.383180 0.784022 0.091752 N\n0.908248 0.616820 0.215978 N\n",
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"formula_full": "Li6 Ca2 Mn2 N6",
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{
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"structure_string": "Cs2 Rb1 Al1 Cl6\n1.0\n0.000000 5.498424 5.498424\n5.498424 0.000000 5.498424\n5.498424 5.498424 0.000000\nCs Rb Al Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Cs\n0.250000 0.250000 0.250000 Cs\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Al\n0.786099 0.213901 0.213901 Cl\n0.213901 0.213901 0.786099 Cl\n0.213901 0.786099 0.786099 Cl\n0.213901 0.786099 0.213901 Cl\n0.786099 0.213901 0.786099 Cl\n0.786099 0.786099 0.213901 Cl\n",
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{
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"created_at": "2022-09-04T14:41:17.122455Z",
"structure_string": "Ba8 Cu4 I4 O8\n1.0\n4.450883 0.000000 0.000000\n0.000000 11.160257 0.000000\n0.000000 0.345228 14.240055\nBa Cu I O\n8 4 4 8\ndirect\n0.750000 0.090093 0.679906 Ba\n0.250000 0.296247 0.894285 Ba\n0.750000 0.169958 0.143495 Ba\n0.750000 0.703753 0.105715 Ba\n0.250000 0.909907 0.320094 Ba\n0.250000 0.419570 0.405108 Ba\n0.750000 0.580430 0.594892 Ba\n0.250000 0.830042 0.856505 Ba\n0.250000 0.331643 0.653838 Cu\n0.750000 0.668357 0.346162 Cu\n0.250000 0.934134 0.091428 Cu\n0.750000 0.065866 0.908572 Cu\n0.750000 0.152149 0.413812 I\n0.250000 0.436812 0.143888 I\n0.750000 0.563188 0.856112 I\n0.250000 0.847851 0.586188 I\n0.750000 0.943037 0.826641 O\n0.750000 0.533858 0.418823 O\n0.750000 0.802368 0.271172 O\n0.250000 0.790642 0.033588 O\n0.250000 0.466142 0.581177 O\n0.250000 0.197632 0.728828 O\n0.750000 0.209358 0.966412 O\n0.250000 0.056963 0.173359 O\n",
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{
"id": "mp-532676",
"created_at": "2022-09-04T14:41:17.125304Z",
"structure_string": "Li2 Mg2 Al6 Se12 O48\n1.0\n8.530388 0.000000 0.000000\n0.040786 9.091109 0.000000\n0.014790 1.096190 12.417750\nLi Mg Al Se O\n2 2 6 12 48\ndirect\n0.775641 0.598509 0.030065 Li\n0.331509 0.726271 0.907221 Li\n0.497274 0.789013 0.145870 Mg\n0.998612 0.707403 0.845678 Mg\n0.501537 0.799348 0.646154 Al\n0.499165 0.217380 0.855647 Al\n0.997635 0.288176 0.641328 Al\n0.002022 0.296733 0.152066 Al\n0.001654 0.713686 0.360297 Al\n0.498352 0.194794 0.351338 Al\n0.856910 0.641004 0.603407 Se\n0.790525 0.000161 0.251916 Se\n0.648308 0.136837 0.606723 Se\n0.356540 0.152063 0.105356 Se\n0.854654 0.351781 0.895107 Se\n0.292795 0.500944 0.747934 Se\n0.713939 0.491444 0.251137 Se\n0.133966 0.638866 0.111272 Se\n0.641159 0.862906 0.885273 Se\n0.351884 0.856611 0.397757 Se\n0.222244 0.009824 0.746033 Se\n0.143043 0.356090 0.394809 Se\n0.813176 0.607804 0.320075 O\n0.671199 0.658908 0.643835 O\n0.987402 0.703420 0.685563 O\n0.879622 0.735299 0.483942 O\n0.938553 0.915137 0.318826 O\n0.654774 0.952746 0.633836 O\n0.667915 0.057375 0.345938 O\n0.586216 0.031524 0.907799 O\n0.856193 0.141525 0.169722 O\n0.309964 0.134552 0.815336 O\n0.526178 0.191883 0.506231 O\n0.830505 0.187113 0.575763 O\n0.169238 0.165597 0.142938 O\n0.588909 0.218374 0.713755 O\n0.478259 0.215277 0.197162 O\n0.921522 0.279648 0.786447 O\n0.390816 0.252799 0.989450 O\n0.675030 0.292592 0.926789 O\n0.978154 0.299076 0.995019 O\n0.651308 0.355494 0.338436 O\n0.446501 0.415482 0.808209 O\n0.882007 0.460113 0.592922 O\n0.832993 0.436771 0.150842 O\n0.149732 0.455589 0.137827 O\n0.837705 0.536039 0.880199 O\n0.195121 0.570035 0.849259 O\n0.113565 0.535473 0.405732 O\n0.573636 0.573310 0.177019 O\n0.356810 0.636303 0.659964 O\n0.998389 0.687957 0.018333 O\n0.307746 0.695156 0.064009 O\n0.612978 0.751925 0.997482 O\n0.090928 0.724209 0.220079 O\n0.509413 0.789456 0.801904 O\n0.416130 0.768714 0.297104 O\n0.823699 0.862287 0.844681 O\n0.169297 0.807841 0.432027 O\n0.477031 0.808041 0.497710 O\n0.704441 0.888919 0.173374 O\n0.169197 0.873023 0.836833 O\n0.381610 0.975302 0.093258 O\n0.335906 0.946590 0.650273 O\n0.347060 0.041372 0.369457 O\n0.066747 0.088098 0.685309 O\n0.109615 0.260291 0.512072 O\n0.018778 0.289890 0.306814 O\n0.331694 0.339127 0.361443 O\n0.186470 0.391203 0.678115 O\n",
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{
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"structure_string": "Sr8 Fe4 Re4 O24\n1.0\n4.867792 -0.001207 -2.781225\n-1.594709 4.595526 2.856361\n8.049004 -9.213520 14.066454\nSr Fe Re O\n8 4 4 24\ndirect\n0.687596 0.375853 0.062707 Sr\n0.186941 0.374321 0.561396 Sr\n0.937249 0.874816 0.812225 Sr\n0.437989 0.875178 0.313773 Sr\n0.313117 0.625719 0.938697 Sr\n0.812394 0.624135 0.437179 Sr\n0.562751 0.125261 0.687966 Sr\n0.061942 0.124781 0.186090 Sr\n0.874734 0.749365 0.624454 Fe\n0.625261 0.250461 0.875619 Fe\n0.374656 0.752007 0.127838 Fe\n0.125422 0.247992 0.372101 Fe\n0.999848 0.999637 0.999170 Re\n0.500227 0.000417 0.500863 Re\n0.250000 0.500000 0.750021 Re\n0.749965 0.499957 0.249950 Re\n0.816849 0.631946 0.938515 O\n0.315350 0.631781 0.438927 O\n0.066582 0.132577 0.688955 O\n0.566516 0.131850 0.188335 O\n0.184496 0.367963 0.061022 O\n0.683332 0.368375 0.561553 O\n0.433463 0.867534 0.811082 O\n0.933384 0.867997 0.311594 O\n0.280213 0.139925 0.929714 O\n0.781084 0.140138 0.430364 O\n0.528922 0.640399 0.679825 O\n0.030578 0.641553 0.179315 O\n0.478883 0.396194 0.802337 O\n0.979481 0.394891 0.302564 O\n0.727880 0.895168 0.552796 O\n0.227338 0.895389 0.052466 O\n0.772271 0.104689 0.947272 O\n0.272493 0.104783 0.447512 O\n0.021226 0.603834 0.697704 O\n0.520401 0.605070 0.197360 O\n0.971026 0.359612 0.820218 O\n0.469479 0.358440 0.320603 O\n0.219555 0.860067 0.570373 O\n0.719105 0.859924 0.069550 O\n",
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{
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