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{
"id": "mp-1213901",
"created_at": "2022-09-04T14:43:59.888783Z",
"structure_string": "Ce4 Re6 O19\n1.0\n-4.517932 4.517932 4.517932\n4.517932 -4.517932 4.517932\n4.517932 4.517932 -4.517932\nCe Re O\n4 6 19\ndirect\n0.687723 0.687723 0.687723 Ce\n0.312277 0.000000 0.000000 Ce\n0.000000 0.312277 0.000000 Ce\n0.000000 0.000000 0.312277 Ce\n0.366094 0.866094 0.500000 Re\n0.633906 0.133906 0.500000 Re\n0.866094 0.500000 0.366094 Re\n0.133906 0.500000 0.633906 Re\n0.500000 0.366094 0.866094 Re\n0.500000 0.633906 0.133906 Re\n0.683324 0.683324 0.000000 O\n0.316676 0.316676 0.000000 O\n0.683324 0.000000 0.683324 O\n0.316676 0.000000 0.316676 O\n0.000000 0.683324 0.683324 O\n0.000000 0.316676 0.316676 O\n0.000000 0.000000 0.000000 O\n0.355655 0.618644 0.300048 O\n0.644345 0.944392 0.262988 O\n0.681404 0.381356 0.737012 O\n0.618644 0.300048 0.355655 O\n0.318596 0.055608 0.699952 O\n0.944392 0.262988 0.644345 O\n0.381356 0.737012 0.681404 O\n0.055608 0.699952 0.318596 O\n0.300048 0.355655 0.618644 O\n0.737012 0.681404 0.381356 O\n0.699952 0.318596 0.055608 O\n0.262988 0.644345 0.944392 O\n",
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{
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"structure_string": "Mn1 Sb3 P4 O16\n1.0\n6.702514 0.000000 0.000000\n0.000000 4.990134 0.000000\n0.000000 0.234918 10.294031\nMn Sb P O\n1 3 4 16\ndirect\n0.500000 0.930559 0.720488 Mn\n0.000000 0.061051 0.281835 Sb\n0.000000 0.444264 0.786321 Sb\n0.500000 0.545026 0.216163 Sb\n0.500000 0.100774 0.409487 P\n0.500000 0.383630 0.895774 P\n0.000000 0.633845 0.090553 P\n0.000000 0.884612 0.604231 P\n0.500000 0.161290 0.552880 O\n0.322072 0.247262 0.332492 O\n0.677928 0.247262 0.332492 O\n0.000000 0.192910 0.615877 O\n0.000000 0.328188 0.098654 O\n0.317159 0.253495 0.822332 O\n0.682841 0.253495 0.822332 O\n0.500000 0.293132 0.040768 O\n0.000000 0.730365 0.947136 O\n0.821619 0.762499 0.169716 O\n0.178381 0.762499 0.169716 O\n0.500000 0.687306 0.881250 O\n0.500000 0.797577 0.388686 O\n0.820501 0.744923 0.680005 O\n0.179499 0.744923 0.680005 O\n0.000000 0.809113 0.460803 O\n",
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"formula_full": "Mn1 Sb3 P4 O16",
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{
"id": "mp-756659",
"created_at": "2022-09-04T14:44:00.376778Z",
"structure_string": "Li12 Ni4 P4 C4 O28\n1.0\n-0.001069 -0.000180 6.345187\n8.554449 0.005325 -0.001448\n0.797421 9.739230 -0.000409\nLi Ni P C O\n12 4 4 4 28\ndirect\n0.262140 0.109485 0.387364 Li\n0.261880 0.109410 0.887261 Li\n0.761873 0.890578 0.112740 Li\n0.762072 0.890444 0.612624 Li\n0.484818 0.281060 0.122279 Li\n0.484637 0.281134 0.622462 Li\n0.985082 0.719033 0.377585 Li\n0.985163 0.719026 0.877686 Li\n0.743189 0.358666 0.389538 Li\n0.743291 0.358293 0.889589 Li\n0.243381 0.641760 0.110382 Li\n0.243307 0.641373 0.610450 Li\n0.998276 0.264420 0.627718 Ni\n0.498742 0.735271 0.372228 Ni\n0.998820 0.265115 0.128085 Ni\n0.499016 0.734807 0.871860 Ni\n0.248026 0.409346 0.362078 P\n0.247764 0.409191 0.862116 P\n0.747899 0.590813 0.137834 P\n0.748091 0.590596 0.637942 P\n0.760771 0.042722 0.354422 C\n0.760523 0.042589 0.854441 C\n0.260533 0.957408 0.145645 C\n0.260737 0.957248 0.645566 C\n0.765817 0.066340 0.481732 O\n0.764953 0.066217 0.981751 O\n0.265121 0.933846 0.018361 O\n0.265806 0.933651 0.518280 O\n0.237636 0.101574 0.184522 O\n0.237210 0.101426 0.684283 O\n0.737776 0.898528 0.315643 O\n0.737827 0.898435 0.815547 O\n0.774508 0.157347 0.259354 O\n0.774472 0.157325 0.759370 O\n0.274564 0.842702 0.240696 O\n0.274764 0.842678 0.740649 O\n0.055668 0.316976 0.425863 O\n0.055655 0.316818 0.926232 O\n0.555864 0.683388 0.073824 O\n0.555824 0.683080 0.574158 O\n0.441391 0.310992 0.411224 O\n0.441401 0.310887 0.910942 O\n0.941497 0.689103 0.088875 O\n0.941525 0.689029 0.588755 O\n0.751186 0.419475 0.097102 O\n0.751073 0.419363 0.596965 O\n0.251353 0.580569 0.403062 O\n0.251325 0.580512 0.902912 O\n0.226730 0.414063 0.201721 O\n0.225992 0.413635 0.701864 O\n0.726161 0.586302 0.298119 O\n0.726871 0.585951 0.798294 O\n",
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"formula_full": "Li12 Ni4 P4 C4 O28",
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"spacegroup": 4
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{
"id": "mp-1228233",
"created_at": "2022-09-04T14:44:00.382612Z",
"structure_string": "Ba6 Zn2 Ir2 Ru2 O18\n1.0\n2.927077 -5.069847 0.000000\n2.927077 5.069847 0.000000\n0.000000 0.000000 14.347603\nBa Zn Ir Ru O\n6 2 2 2 18\ndirect\n0.000000 0.000000 0.248984 Ba\n0.000000 0.000000 0.751016 Ba\n0.333333 0.666667 0.586493 Ba\n0.666667 0.333333 0.413507 Ba\n0.666667 0.333333 0.084982 Ba\n0.333333 0.666667 0.915018 Ba\n0.000000 0.000000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n0.666667 0.333333 0.839892 Ir\n0.333333 0.666667 0.160108 Ir\n0.333333 0.666667 0.342483 Ru\n0.666667 0.333333 0.657517 Ru\n0.488293 0.511707 0.250301 O\n0.488293 0.976586 0.250301 O\n0.023414 0.511707 0.250301 O\n0.511707 0.488293 0.749699 O\n0.511707 0.023414 0.749699 O\n0.976586 0.488293 0.749699 O\n0.172125 0.827875 0.083954 O\n0.172125 0.344251 0.083954 O\n0.655749 0.827875 0.083954 O\n0.827875 0.172125 0.916046 O\n0.827875 0.655749 0.916046 O\n0.344251 0.172125 0.916046 O\n0.827534 0.172466 0.584206 O\n0.827534 0.655068 0.584206 O\n0.344932 0.172466 0.584206 O\n0.172466 0.827534 0.415794 O\n0.172466 0.344932 0.415794 O\n0.655068 0.827534 0.415794 O\n",
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{
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"created_at": "2022-09-04T14:44:00.396265Z",
"structure_string": "Cd1 C12 S4 N6\n1.0\n0.108933 -0.000410 6.065375\n7.240617 -0.195638 -0.824138\n-3.766948 12.622265 -1.604054\nCd C S N\n1 12 4 6\ndirect\n0.000000 0.000000 0.000000 Cd\n0.623594 0.397866 0.683672 C\n0.376406 0.602134 0.316328 C\n0.862494 0.397170 0.704282 C\n0.137506 0.602830 0.295718 C\n0.760490 0.512135 0.648036 C\n0.239510 0.487865 0.351964 C\n0.284857 0.225506 0.723715 C\n0.715143 0.774494 0.276286 C\n0.478809 0.751091 0.966003 C\n0.521191 0.248909 0.033997 C\n0.906098 0.860206 0.718751 C\n0.093902 0.139794 0.281249 C\n0.219200 0.664115 0.963760 S\n0.780800 0.335885 0.036240 S\n0.830485 0.704486 0.594756 S\n0.169515 0.295514 0.405244 S\n0.430257 0.318438 0.698578 N\n0.569743 0.681562 0.301422 N\n0.668208 0.808557 0.966178 N\n0.331792 0.191443 0.033822 N\n0.942867 0.955645 0.808260 N\n0.057133 0.044355 0.191740 N\n",
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{
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{
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"structure_string": "V1 Mo6 Se8\n1.0\n4.693538 -4.759681 0.000000\n4.693538 4.759681 0.000000\n-0.133217 0.000000 6.683271\nV Mo Se\n1 6 8\ndirect\n0.000000 0.000000 0.000000 V\n0.226864 0.549988 0.423516 Mo\n0.773136 0.450012 0.576484 Mo\n0.423516 0.226864 0.549988 Mo\n0.576484 0.773136 0.450012 Mo\n0.549988 0.423516 0.226864 Mo\n0.450012 0.576484 0.773136 Mo\n0.122109 0.359902 0.758614 Se\n0.877891 0.640098 0.241386 Se\n0.224494 0.224494 0.224494 Se\n0.775506 0.775506 0.775506 Se\n0.359902 0.758614 0.122109 Se\n0.640098 0.241386 0.877891 Se\n0.758614 0.122109 0.359902 Se\n0.241386 0.877891 0.640098 Se\n",
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{
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{
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{
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{
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}