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{
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{
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{
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"structure_string": "Li4 V3 Fe3 Te2 O16\n1.0\n6.021603 0.080491 0.028706\n-2.941328 5.167354 -0.009730\n0.042740 0.009016 10.231685\nLi V Fe Te O\n4 3 3 2 16\ndirect\n0.331469 0.675782 0.901141 Li\n0.997400 0.993350 0.994745 Li\n0.991525 0.998613 0.484709 Li\n0.673440 0.330124 0.406755 Li\n0.642518 0.799520 0.227016 V\n0.812567 0.659503 0.720278 V\n0.827144 0.172718 0.715110 V\n0.180482 0.840011 0.219307 Fe\n0.167187 0.341966 0.214951 Fe\n0.337486 0.163674 0.711676 Fe\n0.306940 0.656654 0.493702 Te\n0.662934 0.321143 0.008172 Te\n0.142954 0.829278 0.596150 O\n0.042988 0.526638 0.356748 O\n0.348720 0.687584 0.107895 O\n0.981711 0.984339 0.303103 O\n0.005339 0.998844 0.809939 O\n0.150510 0.316598 0.594342 O\n0.491090 0.972570 0.332630 O\n0.517239 0.527630 0.333774 O\n0.328092 0.160509 0.096243 O\n0.716323 0.873351 0.611808 O\n0.524084 0.510936 0.813394 O\n0.519118 0.028848 0.823015 O\n0.669474 0.337347 0.608685 O\n0.834067 0.663748 0.106862 O\n0.977602 0.480964 0.815736 O\n0.819600 0.148057 0.099955 O\n",
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"formula_full": "Li4 V3 Fe3 Te2 O16",
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{
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"created_at": "2022-09-04T14:46:58.606467Z",
"structure_string": "Rb3 Al1 I6\n1.0\n0.000000 6.242303 6.242303\n6.242303 0.000000 6.242303\n6.242303 6.242303 0.000000\nRb Al I\n3 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Al\n0.777716 0.222284 0.222284 I\n0.222284 0.222284 0.777716 I\n0.222284 0.777716 0.777716 I\n0.222284 0.777716 0.222284 I\n0.777716 0.222284 0.777716 I\n0.777716 0.777716 0.222284 I\n",
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{
"id": "mp-757513",
"created_at": "2022-09-04T14:46:56.794079Z",
"structure_string": "Li8 Mn12 Co4 O32\n1.0\n8.302939 0.000000 0.000000\n0.000000 8.302939 0.000000\n0.000000 0.000000 8.302939\nLi Mn Co O\n8 12 4 32\ndirect\n0.124442 0.875558 0.375558 Li\n0.251610 0.751610 0.748390 Li\n0.248390 0.248390 0.248390 Li\n0.375558 0.124442 0.875558 Li\n0.624442 0.624442 0.624442 Li\n0.751610 0.748390 0.251610 Li\n0.748390 0.251610 0.751610 Li\n0.875558 0.375558 0.124442 Li\n0.124199 0.623016 0.121990 Mn\n0.123016 0.378010 0.875801 Mn\n0.121990 0.124199 0.623016 Mn\n0.378010 0.875801 0.123016 Mn\n0.376984 0.621990 0.375801 Mn\n0.375801 0.376984 0.621990 Mn\n0.624199 0.876984 0.878010 Mn\n0.623016 0.121990 0.124199 Mn\n0.621990 0.375801 0.376984 Mn\n0.878010 0.624199 0.876984 Mn\n0.876984 0.878010 0.624199 Mn\n0.875801 0.123016 0.378010 Mn\n0.997033 0.502967 0.497033 Co\n0.502967 0.497033 0.997033 Co\n0.497033 0.997033 0.502967 Co\n0.002967 0.002967 0.002967 Co\n0.101541 0.127854 0.393304 O\n0.106696 0.898459 0.627854 O\n0.113956 0.613956 0.886044 O\n0.127854 0.393304 0.101541 O\n0.121590 0.147330 0.859720 O\n0.135859 0.364141 0.635859 O\n0.140280 0.621590 0.352670 O\n0.147330 0.859720 0.121590 O\n0.352670 0.140280 0.621590 O\n0.359720 0.378410 0.852670 O\n0.364141 0.635859 0.135859 O\n0.378410 0.852670 0.359720 O\n0.372146 0.606696 0.601541 O\n0.386044 0.386044 0.386044 O\n0.393304 0.101541 0.127854 O\n0.398459 0.872146 0.893304 O\n0.601541 0.372146 0.606696 O\n0.606696 0.601541 0.372146 O\n0.613956 0.886044 0.113956 O\n0.627854 0.106696 0.898459 O\n0.621590 0.352670 0.140280 O\n0.635859 0.135859 0.364141 O\n0.640280 0.878410 0.647330 O\n0.647330 0.640280 0.878410 O\n0.852670 0.359720 0.378410 O\n0.859720 0.121590 0.147330 O\n0.864141 0.864141 0.864141 O\n0.878410 0.647330 0.640280 O\n0.872146 0.893304 0.398459 O\n0.886044 0.113956 0.613956 O\n0.893304 0.398459 0.872146 O\n0.898459 0.627854 0.106696 O\n",
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"formula_full": "Li8 Mn12 Co4 O32",
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{
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"structure_string": "Cu1 Au1 F5\n1.0\n3.788839 0.000000 0.000000\n-1.540460 4.907712 0.000000\n-0.820047 -0.317587 5.475201\nCu Au F\n1 1 5\ndirect\n0.000000 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Au\n0.500000 0.500000 0.500000 F\n0.883037 0.152912 0.680610 F\n0.181028 0.729004 0.835287 F\n0.818972 0.270996 0.164713 F\n0.116963 0.847088 0.319390 F\n",
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{
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"structure_string": "Sr2 Ca1 Ti6 N2 O11\n1.0\n-0.069634 3.883743 0.041157\n-7.307501 2.104634 0.458971\n-1.891177 0.110678 9.918088\nSr Ca Ti N O\n2 1 6 2 11\ndirect\n0.445587 0.970039 0.522587 Sr\n0.475685 0.063021 0.182496 Sr\n0.570084 0.961945 0.862613 Ca\n0.164157 0.719289 0.080201 Ti\n0.168886 0.654067 0.421318 Ti\n0.220117 0.548614 0.758226 Ti\n0.784851 0.464812 0.258246 Ti\n0.848989 0.339967 0.596975 Ti\n0.866641 0.281766 0.949382 Ti\n0.243646 0.540850 0.264694 N\n0.841069 0.329022 0.119667 N\n0.041667 0.908249 0.338787 O\n0.074404 0.763052 0.620417 O\n0.164328 0.683487 0.904401 O\n0.645404 0.743720 0.106524 O\n0.685968 0.626470 0.448856 O\n0.757672 0.481799 0.767342 O\n0.314789 0.402316 0.590078 O\n0.375696 0.268946 0.908119 O\n0.906736 0.259052 0.429055 O\n0.015402 0.104428 0.711450 O\n0.012215 0.003435 0.013263 O\n",
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{
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{
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{
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"elements": [
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],
"chemical_system": "In-Ni",
"density": 8.789728317989644,
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{
"id": "mp-1518902",
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"structure_string": "K1 La1 Sn4 O12\n1.0\n0.000000 -4.086043 -4.068624\n0.000000 -4.086043 4.068624\n-8.244211 0.000000 0.000000\nK La Sn O\n1 1 4 12\ndirect\n0.998528 0.001472 0.500000 K\n0.500728 0.499272 0.000000 La\n0.497907 0.000407 0.256792 Sn\n0.497907 0.000407 0.743208 Sn\n0.999593 0.502093 0.743208 Sn\n0.999593 0.502093 0.256792 Sn\n0.276771 0.280028 0.221066 O\n0.719972 0.723229 0.221066 O\n0.719972 0.723229 0.778934 O\n0.276771 0.280028 0.778934 O\n0.253399 0.746601 0.204045 O\n0.765162 0.234838 0.255707 O\n0.765162 0.234838 0.744293 O\n0.253399 0.746601 0.795955 O\n0.518370 0.049692 0.000000 O\n0.477993 0.981635 0.500000 O\n0.950308 0.481630 0.000000 O\n0.018365 0.522007 0.500000 O\n",
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"chemical_system": "K-La-O-Sn",
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]
}