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{
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{
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{
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"structure_string": "Nd3 Ni9\n1.0\n8.397030 -2.500887 0.000000\n8.397030 2.500887 0.000000\n7.652191 0.000000 4.267144\nNd Ni\n3 9\ndirect\n0.860722 0.860722 0.860722 Nd\n0.139278 0.139278 0.139278 Nd\n0.000000 0.000000 0.000000 Nd\n0.420033 0.916706 0.420033 Ni\n0.420033 0.420033 0.916706 Ni\n0.916706 0.420033 0.420033 Ni\n0.579967 0.083294 0.579967 Ni\n0.579967 0.579967 0.083294 Ni\n0.083294 0.579967 0.579967 Ni\n0.667124 0.667124 0.667124 Ni\n0.332876 0.332876 0.332876 Ni\n0.500000 0.500000 0.500000 Ni\n",
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{
"id": "mp-1203761",
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"structure_string": "Zn18 S18\n1.0\n-1.936963 -3.354918 -0.000000\n1.936963 -3.354918 -0.000000\n-0.000000 -2.236612 56.345446\nZn S\n18 18\ndirect\n0.999996 0.999996 0.000012 Zn\n0.944437 0.944437 0.166690 Zn\n0.870371 0.870371 0.388886 Zn\n0.814809 0.814809 0.555572 Zn\n0.759257 0.759257 0.722228 Zn\n0.722212 0.722212 0.833364 Zn\n0.648151 0.648151 0.055546 Zn\n0.592586 0.592586 0.222242 Zn\n0.555553 0.555553 0.333340 Zn\n0.499998 0.499998 0.500005 Zn\n0.462953 0.462953 0.611142 Zn\n0.407406 0.407406 0.777782 Zn\n0.351852 0.351852 0.944443 Zn\n0.296297 0.296297 0.111108 Zn\n0.240738 0.240738 0.277785 Zn\n0.185185 0.185185 0.444445 Zn\n0.111107 0.111107 0.666679 Zn\n0.037039 0.037039 0.888884 Zn\n0.986117 0.986117 0.041648 S\n0.930567 0.930567 0.208299 S\n0.856493 0.856493 0.430521 S\n0.800920 0.800920 0.597241 S\n0.745400 0.745400 0.763800 S\n0.708345 0.708345 0.874964 S\n0.634271 0.634271 0.097188 S\n0.578730 0.578730 0.263811 S\n0.541677 0.541677 0.374969 S\n0.486139 0.486139 0.541582 S\n0.449081 0.449081 0.652757 S\n0.393519 0.393519 0.819443 S\n0.337958 0.337958 0.986125 S\n0.282421 0.282421 0.152736 S\n0.226848 0.226848 0.319456 S\n0.171315 0.171315 0.486056 S\n0.097234 0.097234 0.708298 S\n0.023176 0.023176 0.930473 S\n",
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{
"id": "mp-5966",
"created_at": "2022-09-04T14:44:15.624422Z",
"structure_string": "Cd4 Sn2 O8\n1.0\n3.249369 0.000000 0.000000\n0.000000 5.664769 0.000000\n0.000000 0.000000 10.127103\nCd Sn O\n4 2 8\ndirect\n0.500000 0.059658 0.323797 Cd\n0.500000 0.940342 0.676203 Cd\n0.500000 0.440342 0.823797 Cd\n0.500000 0.559658 0.176203 Cd\n0.000000 0.000000 0.000000 Sn\n0.000000 0.500000 0.500000 Sn\n0.000000 0.134278 0.808346 O\n0.000000 0.865722 0.191654 O\n0.000000 0.634278 0.691654 O\n0.000000 0.365722 0.308346 O\n0.500000 0.264668 0.538979 O\n0.500000 0.735332 0.461021 O\n0.500000 0.235332 0.038979 O\n0.500000 0.764668 0.961021 O\n",
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{
"id": "mp-1037956",
"created_at": "2022-09-04T14:44:17.021544Z",
"structure_string": "Ca1 Mg30 Zn1 O32\n1.0\n8.568880 0.000000 0.000000\n0.000000 8.568880 0.000000\n0.000000 0.000000 8.554858\nCa Mg Zn O\n1 30 1 32\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.253267 0.000000 0.252906 Mg\n0.253267 0.000000 0.747094 Mg\n0.746733 0.000000 0.252906 Mg\n0.746733 0.000000 0.747094 Mg\n0.250030 0.500000 0.250322 Mg\n0.250030 0.500000 0.749678 Mg\n0.749970 0.500000 0.250322 Mg\n0.749970 0.500000 0.749678 Mg\n0.000000 0.253267 0.252906 Mg\n0.000000 0.253267 0.747094 Mg\n0.500000 0.250030 0.250322 Mg\n0.500000 0.250030 0.749678 Mg\n0.000000 0.746733 0.252906 Mg\n0.000000 0.746733 0.747094 Mg\n0.500000 0.749970 0.250322 Mg\n0.500000 0.749970 0.749678 Mg\n0.252718 0.252718 0.000000 Mg\n0.250027 0.250027 0.500000 Mg\n0.747282 0.252718 0.000000 Mg\n0.749973 0.250027 0.500000 Mg\n0.252718 0.747282 0.000000 Mg\n0.250027 0.749973 0.500000 Mg\n0.747282 0.747282 0.000000 Mg\n0.749973 0.749973 0.500000 Mg\n0.000000 0.000000 0.500000 Zn\n0.000000 0.262190 0.000000 O\n0.000000 0.256491 0.500000 O\n0.500000 0.252343 0.000000 O\n0.500000 0.250592 0.500000 O\n0.000000 0.737810 0.000000 O\n0.000000 0.743509 0.500000 O\n0.500000 0.747657 0.000000 O\n0.500000 0.749408 0.500000 O\n0.249539 0.249539 0.250000 O\n0.249539 0.249539 0.750000 O\n0.750461 0.249539 0.250000 O\n0.750461 0.249539 0.750000 O\n0.249539 0.750461 0.250000 O\n0.249539 0.750461 0.750000 O\n0.750461 0.750461 0.250000 O\n0.750461 0.750461 0.750000 O\n0.000000 0.000000 0.261044 O\n0.000000 0.000000 0.738956 O\n0.500000 0.000000 0.251841 O\n0.500000 0.000000 0.748159 O\n0.000000 0.500000 0.251841 O\n0.000000 0.500000 0.748159 O\n0.500000 0.500000 0.250104 O\n0.500000 0.500000 0.749896 O\n0.262190 0.000000 0.000000 O\n0.256491 0.000000 0.500000 O\n0.737810 0.000000 0.000000 O\n0.743509 0.000000 0.500000 O\n0.252343 0.500000 0.000000 O\n0.250592 0.500000 0.500000 O\n0.747657 0.500000 0.000000 O\n0.749408 0.500000 0.500000 O\n",
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{
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{
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{
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{
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},
{
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"structure_string": "Li6 Ni3 Sn1 P6 O24\n1.0\n8.575464 0.000000 0.000000\n4.049777 7.632412 0.000000\n4.039451 2.459840 7.230462\nLi Ni Sn P O\n6 3 1 6 24\ndirect\n0.978979 0.998401 0.985220 Li\n0.256992 0.652128 0.848327 Li\n0.520700 0.513874 0.498082 Li\n0.697026 0.357782 0.164690 Li\n0.354825 0.164237 0.697386 Li\n0.166107 0.692625 0.357815 Li\n0.859270 0.853306 0.855471 Ni\n0.642426 0.644437 0.645961 Ni\n0.353817 0.350137 0.352929 Ni\n0.144942 0.144386 0.148592 Sn\n0.251608 0.951339 0.554855 P\n0.947094 0.554614 0.253746 P\n0.556388 0.249068 0.950145 P\n0.748591 0.045316 0.459244 P\n0.452765 0.745440 0.042387 P\n0.050712 0.461359 0.751522 P\n0.877541 0.506209 0.713581 O\n0.697974 0.883943 0.492917 O\n0.943804 0.736724 0.087241 O\n0.454832 0.699655 0.890385 O\n0.982396 0.391942 0.194808 O\n0.758059 0.572312 0.406598 O\n0.745467 0.094729 0.924066 O\n0.551475 0.414107 0.768672 O\n0.814161 0.010397 0.612098 O\n0.402663 0.758307 0.570314 O\n0.897359 0.082795 0.257547 O\n0.615917 0.802835 0.992527 O\n0.395576 0.182514 0.992656 O\n0.098554 0.927293 0.746978 O\n0.585500 0.233078 0.446801 O\n0.184050 0.990589 0.397632 O\n0.447375 0.580196 0.229879 O\n0.253078 0.896546 0.091804 O\n0.234041 0.442470 0.582845 O\n0.045239 0.605243 0.812317 O\n0.526840 0.302394 0.111020 O\n0.084932 0.257452 0.900444 O\n0.312692 0.107724 0.521340 O\n0.108234 0.519090 0.312160 O\n",
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"formula_full": "Li6 Ni3 Sn1 P6 O24",
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{
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],
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"formula_full": "Mg3 Si9 B36 C1",
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}
]
}