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{
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{
"id": "mp-756806",
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"structure_string": "Li4 Mn3 Cr1 P4 O16\n1.0\n6.226091 0.000000 0.000000\n0.000000 4.791386 0.000000\n0.000000 0.177658 10.472894\nLi Mn Cr P O\n4 3 1 4 16\ndirect\n0.249345 0.002993 0.998521 Li\n0.750655 0.002993 0.998521 Li\n0.751221 0.499621 0.501068 Li\n0.248779 0.499621 0.501068 Li\n0.000000 0.029716 0.280842 Mn\n0.000000 0.469807 0.782062 Mn\n0.500000 0.529332 0.218503 Mn\n0.500000 0.951777 0.715952 Cr\n0.500000 0.085917 0.410031 P\n0.500000 0.411337 0.904832 P\n0.000000 0.592272 0.092392 P\n0.000000 0.911878 0.591869 P\n0.500000 0.196738 0.549270 O\n0.300995 0.222820 0.341263 O\n0.699005 0.222820 0.341263 O\n0.000000 0.233242 0.594102 O\n0.000000 0.270639 0.097575 O\n0.298483 0.281537 0.839367 O\n0.701517 0.281537 0.839367 O\n0.500000 0.295909 0.044904 O\n0.000000 0.716009 0.954284 O\n0.800591 0.722813 0.161627 O\n0.199409 0.722813 0.161627 O\n0.500000 0.734866 0.895989 O\n0.500000 0.764856 0.404760 O\n0.802194 0.777804 0.662069 O\n0.197806 0.777804 0.662069 O\n0.000000 0.790530 0.454803 O\n",
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{
"id": "mp-1013849",
"created_at": "2022-09-04T14:42:51.121850Z",
"structure_string": "Li12 Fe8 Ge12 O48\n1.0\n-6.065559 6.065559 6.065559\n6.065559 -6.065559 6.065559\n6.065559 6.065559 -6.065559\nLi Fe Ge O\n12 8 12 48\ndirect\n0.750000 0.625000 0.875000 Li\n0.250000 0.875000 0.625000 Li\n0.625000 0.250000 0.875000 Li\n0.875000 0.750000 0.625000 Li\n0.875000 0.625000 0.250000 Li\n0.625000 0.875000 0.750000 Li\n0.250000 0.375000 0.125000 Li\n0.750000 0.125000 0.375000 Li\n0.375000 0.750000 0.125000 Li\n0.125000 0.250000 0.375000 Li\n0.125000 0.375000 0.750000 Li\n0.375000 0.125000 0.250000 Li\n0.500000 0.000000 0.500000 Fe\n0.000000 0.500000 0.000000 Fe\n0.500000 0.500000 0.500000 Fe\n0.000000 0.000000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.000000 0.500000 0.500000 Fe\n0.500000 0.500000 0.000000 Fe\n0.500000 0.000000 0.000000 Fe\n0.375000 0.625000 0.750000 Ge\n0.625000 0.375000 0.250000 Ge\n0.625000 0.750000 0.375000 Ge\n0.250000 0.125000 0.875000 Ge\n0.875000 0.250000 0.125000 Ge\n0.750000 0.375000 0.625000 Ge\n0.250000 0.625000 0.375000 Ge\n0.750000 0.875000 0.125000 Ge\n0.125000 0.750000 0.875000 Ge\n0.375000 0.250000 0.625000 Ge\n0.875000 0.125000 0.750000 Ge\n0.125000 0.875000 0.250000 Ge\n0.520351 0.399699 0.819534 O\n0.819534 0.520351 0.399699 O\n0.799183 0.879348 0.979649 O\n0.419835 0.100301 0.620652 O\n0.879348 0.399699 0.080165 O\n0.680466 0.080165 0.700817 O\n0.819534 0.799183 0.419835 O\n0.399699 0.819534 0.520351 O\n0.620652 0.700817 0.520351 O\n0.419835 0.819534 0.799183 O\n0.399699 0.080165 0.879348 O\n0.100301 0.979649 0.680466 O\n0.979649 0.680466 0.100301 O\n0.799183 0.419835 0.819534 O\n0.520351 0.620652 0.700817 O\n0.700817 0.520351 0.620652 O\n0.080165 0.879348 0.399699 O\n0.979649 0.799183 0.879348 O\n0.080165 0.700817 0.680466 O\n0.379348 0.299183 0.479649 O\n0.620652 0.419835 0.100301 O\n0.100301 0.620652 0.419835 O\n0.700817 0.680466 0.080165 O\n0.680466 0.100301 0.979649 O\n0.479649 0.600301 0.180466 O\n0.180466 0.479649 0.600301 O\n0.200817 0.120652 0.020351 O\n0.580165 0.899699 0.379348 O\n0.120652 0.600301 0.919835 O\n0.319534 0.919835 0.299183 O\n0.180466 0.200817 0.580165 O\n0.600301 0.180466 0.479649 O\n0.319534 0.899699 0.020351 O\n0.299183 0.319534 0.919835 O\n0.899699 0.379348 0.580165 O\n0.120652 0.020351 0.200817 O\n0.379348 0.580165 0.899699 O\n0.919835 0.299183 0.319534 O\n0.020351 0.200817 0.120652 O\n0.919835 0.120652 0.600301 O\n0.299183 0.479649 0.379348 O\n0.479649 0.379348 0.299183 O\n0.200817 0.580165 0.180466 O\n0.020351 0.319534 0.899699 O\n0.899699 0.020351 0.319534 O\n0.600301 0.919835 0.120652 O\n0.580165 0.180466 0.200817 O\n0.879348 0.979649 0.799183 O\n",
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"formula_full": "Li12 Fe8 Ge12 O48",
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{
"id": "mp-1236608",
"created_at": "2022-09-04T14:44:04.418655Z",
"structure_string": "Li1 Cr2 Cu2 W4 O16\n1.0\n0.026575 0.022692 -5.116105\n-4.756749 -5.818825 0.084002\n-4.671711 5.748482 0.032717\nLi Cr Cu W O\n1 2 2 4 16\ndirect\n0.745114 0.086874 0.456318 Li\n0.750272 0.816066 0.171893 Cr\n0.255349 0.175199 0.813002 Cr\n0.747454 0.364974 0.694294 Cu\n0.247756 0.663655 0.335669 Cu\n0.753009 0.330795 0.163930 W\n0.244963 0.665483 0.836910 W\n0.748094 0.831684 0.671460 W\n0.246313 0.165804 0.323969 W\n0.409800 0.699225 0.065239 O\n0.584179 0.294642 0.934787 O\n0.072832 0.938610 0.296095 O\n0.918588 0.056793 0.694834 O\n0.919485 0.799750 0.922792 O\n0.074220 0.199529 0.070037 O\n0.596530 0.070541 0.199681 O\n0.422892 0.921105 0.802759 O\n0.885711 0.565932 0.181312 O\n0.115161 0.429362 0.810669 O\n0.618800 0.816386 0.432259 O\n0.412946 0.179319 0.567916 O\n0.558620 0.596079 0.695000 O\n0.435780 0.403365 0.301136 O\n0.924472 0.306945 0.410168 O\n0.061658 0.693312 0.594299 O\n",
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"formula_full": "Li1 Cr2 Cu2 W4 O16",
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{
"id": "mp-753861",
"created_at": "2022-09-04T14:47:20.658409Z",
"structure_string": "Li4 V2 F12\n1.0\n4.684445 0.000000 0.000000\n0.000000 4.684445 0.000000\n0.000000 0.000000 9.152369\nLi V F\n4 2 12\ndirect\n0.000000 0.000000 0.333833 Li\n0.000000 0.000000 0.666167 Li\n0.500000 0.500000 0.166167 Li\n0.500000 0.500000 0.833833 Li\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.500000 V\n0.193445 0.806555 0.154363 F\n0.193445 0.806555 0.845637 F\n0.221337 0.778663 0.500000 F\n0.278663 0.278663 0.000000 F\n0.306555 0.306555 0.345637 F\n0.306555 0.306555 0.654363 F\n0.693445 0.693445 0.345637 F\n0.693445 0.693445 0.654363 F\n0.721337 0.721337 0.000000 F\n0.778663 0.221337 0.500000 F\n0.806555 0.193445 0.845637 F\n0.806555 0.193445 0.154363 F\n",
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"formula_full": "Li4 V2 F12",
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{
"id": "mp-550886",
"created_at": "2022-09-04T14:39:45.714467Z",
"structure_string": "Co4 P4 O14\n1.0\n-0.960030 5.076901 -1.282201\n-0.010324 -0.009291 5.384319\n8.988524 -0.010060 -1.277615\nCo P O\n4 4 14\ndirect\n0.311388 0.687676 0.747070 Co\n0.683332 0.312575 0.252770 Co\n0.312472 0.688122 0.246459 Co\n0.688303 0.311595 0.753143 Co\n0.782525 0.784825 0.047110 P\n0.782624 0.784771 0.547073 P\n0.217682 0.216018 0.452598 P\n0.217994 0.215151 0.953124 P\n0.000031 0.000252 0.999974 O\n0.000054 0.999928 0.499771 O\n0.072369 0.373380 0.359973 O\n0.072554 0.372853 0.859941 O\n0.929404 0.626747 0.139321 O\n0.927639 0.626333 0.639921 O\n0.622213 0.926619 0.139441 O\n0.620911 0.925656 0.639010 O\n0.379760 0.073695 0.361147 O\n0.379717 0.073525 0.861645 O\n0.379268 0.377637 0.106008 O\n0.380062 0.376214 0.605962 O\n0.619201 0.622971 0.394339 O\n0.620500 0.623455 0.894197 O\n",
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{
"id": "mp-1353844",
"created_at": "2022-09-04T14:47:06.156523Z",
"structure_string": "Zn6 Fe12 O24\n1.0\n3.025731 5.247985 0.000000\n-3.025731 5.247985 0.000000\n0.000000 0.113370 14.755929\nZn Fe O\n6 12 24\ndirect\n0.338186 0.338186 0.042225 Zn\n0.667207 0.667207 0.332659 Zn\n0.835181 0.835181 0.167577 Zn\n0.335868 0.335868 0.666809 Zn\n0.501400 0.501400 0.499783 Zn\n0.170440 0.170440 0.832869 Zn\n0.832125 0.333907 0.165829 Fe\n0.005883 0.005883 0.378097 Fe\n0.000190 0.000190 0.002397 Fe\n0.333907 0.832125 0.165829 Fe\n0.500273 0.002994 0.499770 Fe\n0.673604 0.673604 0.709743 Fe\n0.002994 0.500273 0.499770 Fe\n0.168187 0.668040 0.833628 Fe\n0.329241 0.329241 0.288077 Fe\n0.668040 0.168187 0.833628 Fe\n0.997343 0.997343 0.623261 Fe\n0.659926 0.659926 0.959608 Fe\n0.696942 0.162417 0.085662 O\n0.007044 0.007044 0.246404 O\n0.162417 0.696942 0.085662 O\n0.154635 0.154635 0.085769 O\n0.349114 0.837288 0.420823 O\n0.505635 0.505635 0.243404 O\n0.673600 0.673600 0.577367 O\n0.496459 0.988369 0.244117 O\n0.837288 0.349114 0.420823 O\n0.661860 0.661860 0.086937 O\n0.828750 0.828750 0.421746 O\n0.988369 0.496459 0.244117 O\n0.011878 0.509029 0.754259 O\n0.173867 0.173867 0.578371 O\n0.164773 0.655383 0.579312 O\n0.509029 0.011878 0.754259 O\n0.340647 0.340647 0.905973 O\n0.329164 0.329164 0.421414 O\n0.498381 0.498381 0.755713 O\n0.655383 0.164773 0.579312 O\n0.847656 0.847656 0.915416 O\n0.834306 0.317556 0.916960 O\n0.998615 0.998615 0.756730 O\n0.317556 0.834306 0.916960 O\n",
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"formula_full": "Zn6 Fe12 O24",
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{
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"structure_string": "Ta2 Ti2 Cu3 O12\n1.0\n3.759123 5.288172 0.000000\n-3.759123 5.288172 0.000000\n0.000000 5.285261 5.332120\nTa Ti Cu O\n2 2 3 12\ndirect\n0.500000 0.000000 0.000000 Ta\n0.000000 0.500000 0.000000 Ta\n0.500000 0.000000 0.500000 Ti\n0.000000 0.500000 0.500000 Ti\n0.500000 0.500000 0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.500000 0.500000 Cu\n0.183787 0.183787 0.505492 O\n0.816213 0.816213 0.494508 O\n0.818818 0.818818 0.870410 O\n0.181182 0.181182 0.129590 O\n0.506713 0.871852 0.311013 O\n0.493287 0.128148 0.688987 O\n0.871852 0.506713 0.311013 O\n0.128148 0.493287 0.688987 O\n0.310497 0.688951 0.182751 O\n0.689503 0.311049 0.817249 O\n0.311049 0.689503 0.817249 O\n0.688951 0.310497 0.182751 O\n",
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{
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"structure_string": "Mg4 Fe8 O16\n1.0\n5.129874 0.000000 0.000000\n0.000000 5.895949 0.000000\n0.000000 0.000000 10.329059\nMg Fe O\n4 8 16\ndirect\n0.853412 0.000000 0.500000 Mg\n0.146588 0.500000 0.000000 Mg\n0.515957 0.000000 0.000000 Mg\n0.484043 0.500000 0.500000 Mg\n0.509461 0.500000 0.230265 Fe\n0.509461 0.500000 0.769735 Fe\n0.490539 0.000000 0.269735 Fe\n0.490539 0.000000 0.730265 Fe\n0.000000 0.250000 0.250000 Fe\n0.000000 0.750000 0.750000 Fe\n0.000000 0.750000 0.250000 Fe\n0.000000 0.250000 0.750000 Fe\n0.855219 0.500000 0.141380 O\n0.855219 0.500000 0.858620 O\n0.144781 0.000000 0.358620 O\n0.144781 0.000000 0.641380 O\n0.197687 0.500000 0.348969 O\n0.197687 0.500000 0.651031 O\n0.802313 0.000000 0.151031 O\n0.802313 0.000000 0.848969 O\n0.667833 0.253867 0.365486 O\n0.667833 0.746133 0.634514 O\n0.332167 0.753867 0.134514 O\n0.332167 0.246133 0.865486 O\n0.332167 0.246133 0.134514 O\n0.332167 0.753867 0.865486 O\n0.667833 0.746133 0.365486 O\n0.667833 0.253867 0.634514 O\n",
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}