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{
"id": "mp-1219797",
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"structure_string": "Ni6 Sn1 Te2\n1.0\n-1.897477 1.897477 9.681298\n1.897477 -1.897477 9.681298\n1.897477 1.897477 -9.681298\nNi Sn Te\n6 1 2\ndirect\n0.501075 0.501075 0.000000 Ni\n0.906556 0.406556 0.500000 Ni\n0.406556 0.906556 0.500000 Ni\n0.095409 0.595409 0.500000 Ni\n0.595409 0.095409 0.500000 Ni\n0.808853 0.808853 0.000000 Ni\n0.000351 0.000351 0.000000 Sn\n0.316225 0.316225 0.000000 Te\n0.679167 0.679167 0.000000 Te\n",
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{
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},
{
"id": "mp-684768",
"created_at": "2022-09-04T14:47:09.437298Z",
"structure_string": "Sm4 O6\n1.0\n5.457020 0.000000 0.000000\n0.000000 5.457020 0.000000\n0.000000 0.000000 5.457020\nSm O\n4 6\ndirect\n0.750000 0.750000 0.250000 Sm\n0.250000 0.750000 0.750000 Sm\n0.750000 0.250000 0.750000 Sm\n0.250000 0.250000 0.250000 Sm\n0.500000 0.000000 0.000000 O\n0.000000 0.000000 0.500000 O\n0.500000 0.000000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.000000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n",
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"formula_full": "Sm4 O6",
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{
"id": "mp-504304",
"created_at": "2022-09-04T14:47:09.438735Z",
"structure_string": "Li4 Cu4 P4 O16\n1.0\n5.213809 0.000000 0.000000\n0.000000 6.104184 0.000000\n0.000000 0.000000 10.645819\nLi Cu P O\n4 4 4 16\ndirect\n0.299508 0.518311 0.827054 Li\n0.700492 0.018311 0.172946 Li\n0.200492 0.518311 0.327054 Li\n0.799508 0.018311 0.672946 Li\n0.182200 0.745784 0.585081 Cu\n0.817800 0.245784 0.414919 Cu\n0.317800 0.745784 0.085081 Cu\n0.682200 0.245784 0.914919 Cu\n0.804661 0.747511 0.927964 P\n0.304661 0.247511 0.572036 P\n0.695339 0.747511 0.427964 P\n0.195339 0.247511 0.072036 P\n0.774485 0.953570 0.349804 O\n0.600145 0.225076 0.570303 O\n0.681528 0.546468 0.860139 O\n0.225515 0.453570 0.650196 O\n0.796956 0.763179 0.564390 O\n0.818472 0.546468 0.360139 O\n0.274485 0.453570 0.150196 O\n0.296956 0.263179 0.935610 O\n0.899855 0.225076 0.070303 O\n0.100145 0.725076 0.929697 O\n0.203044 0.263179 0.435610 O\n0.318472 0.046468 0.139861 O\n0.181528 0.046468 0.639861 O\n0.725515 0.953570 0.849804 O\n0.399855 0.725076 0.429697 O\n0.703044 0.763179 0.064390 O\n",
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"formula_full": "Li4 Cu4 P4 O16",
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"spacegroup": 33
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{
"id": "mp-1199343",
"created_at": "2022-09-04T14:47:10.208373Z",
"structure_string": "Zn18 S18\n1.0\n-1.936941 -3.354880 0.000000\n1.936941 -3.354880 0.000000\n0.000000 -2.236586 56.347648\nZn S\n18 18\ndirect\n0.999995 0.999995 0.000015 Zn\n0.944439 0.944439 0.166682 Zn\n0.907403 0.907403 0.277791 Zn\n0.851849 0.851849 0.444454 Zn\n0.814807 0.814807 0.555579 Zn\n0.759256 0.759256 0.722233 Zn\n0.722212 0.722212 0.833364 Zn\n0.648149 0.648149 0.055554 Zn\n0.592588 0.592588 0.222236 Zn\n0.537034 0.537034 0.388897 Zn\n0.462960 0.462960 0.611121 Zn\n0.407405 0.407405 0.777785 Zn\n0.351852 0.351852 0.944443 Zn\n0.296295 0.296295 0.111115 Zn\n0.222221 0.222221 0.333336 Zn\n0.166667 0.166667 0.500000 Zn\n0.111106 0.111106 0.666683 Zn\n0.037039 0.037039 0.888884 Zn\n0.986119 0.986119 0.041643 S\n0.930581 0.930581 0.208257 S\n0.893526 0.893526 0.319421 S\n0.837992 0.837992 0.486023 S\n0.800930 0.800930 0.597210 S\n0.745401 0.745401 0.763797 S\n0.708345 0.708345 0.874965 S\n0.634273 0.634273 0.097181 S\n0.578699 0.578699 0.263904 S\n0.523163 0.523163 0.430511 S\n0.449083 0.449083 0.652752 S\n0.393519 0.393519 0.819442 S\n0.337959 0.337959 0.986123 S\n0.282423 0.282423 0.152730 S\n0.208345 0.208345 0.374965 S\n0.152775 0.152775 0.541676 S\n0.097235 0.097235 0.708294 S\n0.023175 0.023175 0.930474 S\n",
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"formula_full": "Zn18 S18",
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{
"id": "mp-559485",
"created_at": "2022-09-04T14:47:09.449493Z",
"structure_string": "V18 O34\n1.0\n5.559256 -0.013483 0.245823\n2.209852 6.716321 0.809139\n-0.766584 0.190507 14.709243\nV O\n18 34\ndirect\n0.325421 0.910599 0.729457 V\n0.674047 0.089013 0.270268 V\n0.743400 0.109888 0.842863 V\n0.256649 0.890058 0.157339 V\n0.342015 0.411118 0.725978 V\n0.657726 0.587943 0.274365 V\n0.916104 0.201340 0.618015 V\n0.084250 0.798277 0.381890 V\n0.249623 0.386844 0.162096 V\n0.749296 0.613029 0.838029 V\n0.809667 0.686106 0.044668 V\n0.190979 0.315426 0.955119 V\n0.929180 0.698649 0.610276 V\n0.071410 0.300699 0.389780 V\n0.807292 0.189770 0.041657 V\n0.193030 0.812163 0.958383 V\n0.500827 0.999646 0.499892 V\n0.500057 0.499641 0.500237 V\n0.151945 0.184224 0.096162 O\n0.848187 0.816948 0.904305 O\n0.973724 0.061239 0.750033 O\n0.025573 0.939065 0.249903 O\n0.202126 0.021343 0.419353 O\n0.798521 0.978345 0.580355 O\n0.209392 0.525826 0.024104 O\n0.791486 0.474929 0.975538 O\n0.705068 0.972691 0.391869 O\n0.295611 0.026374 0.608183 O\n0.550035 0.369668 0.628124 O\n0.450382 0.629946 0.372122 O\n0.791834 0.302515 0.307069 O\n0.208212 0.696748 0.693114 O\n0.629818 0.394629 0.806717 O\n0.368892 0.605487 0.193593 O\n0.146728 0.667304 0.508952 O\n0.853573 0.332678 0.491129 O\n0.461007 0.819875 0.047714 O\n0.539024 0.181915 0.952379 O\n0.034933 0.117993 0.930374 O\n0.964395 0.884512 0.069492 O\n0.448860 0.122551 0.771986 O\n0.551269 0.876570 0.228197 O\n0.392601 0.771845 0.853478 O\n0.606443 0.226849 0.146584 O\n0.030789 0.424723 0.652868 O\n0.969883 0.574770 0.346539 O\n0.376036 0.290985 0.466507 O\n0.624410 0.708547 0.533631 O\n0.301846 0.260035 0.275496 O\n0.698520 0.740282 0.724946 O\n0.114361 0.452443 0.837583 O\n0.883542 0.545933 0.161286 O\n",
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{
"id": "mp-5476",
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"structure_string": "Cs8 Mg6 F20\n1.0\n3.116575 -7.382523 0.000000\n3.116575 7.382523 0.000000\n0.000000 0.000000 13.899735\nCs Mg F\n8 6 20\ndirect\n0.252952 0.747048 0.607817 Cs\n0.747048 0.252952 0.392183 Cs\n0.247048 0.752952 0.107817 Cs\n0.752952 0.247048 0.892183 Cs\n0.949042 0.050958 0.638619 Cs\n0.050958 0.949042 0.361381 Cs\n0.550958 0.449042 0.138619 Cs\n0.449042 0.550958 0.861381 Cs\n0.616780 0.383220 0.657570 Mg\n0.383220 0.616780 0.342430 Mg\n0.883220 0.116780 0.157570 Mg\n0.116780 0.883220 0.842430 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.613230 0.805718 0.459716 F\n0.805718 0.613230 0.540284 F\n0.886770 0.694282 0.959716 F\n0.694282 0.886770 0.040284 F\n0.386770 0.194282 0.540284 F\n0.194282 0.386770 0.459716 F\n0.113230 0.305718 0.040284 F\n0.305718 0.113230 0.959716 F\n0.474037 0.525963 0.642727 F\n0.525963 0.474037 0.357273 F\n0.025963 0.974037 0.142727 F\n0.974037 0.025963 0.857273 F\n0.748177 0.251823 0.649832 F\n0.251823 0.748177 0.350168 F\n0.359660 0.140340 0.750000 F\n0.140340 0.359660 0.250000 F\n0.640340 0.859660 0.250000 F\n0.859660 0.640340 0.750000 F\n0.248177 0.751823 0.850168 F\n0.751823 0.248177 0.149832 F\n",
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{
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{
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"structure_string": "Eu1 Cd2 Sb2\n1.0\n2.383995 -4.129200 0.000000\n2.383995 4.129200 0.000000\n0.000000 0.000000 7.700333\nEu Cd Sb\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Eu\n0.666667 0.333333 0.366036 Cd\n0.333333 0.666667 0.633964 Cd\n0.666667 0.333333 0.756232 Sb\n0.333333 0.666667 0.243768 Sb\n",
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{
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{
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}