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{
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{
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"structure_string": "Li1 Ag3\n1.0\n4.101537 0.000000 0.000000\n0.000000 4.101537 0.000000\n0.000000 0.000000 4.101537\nLi Ag\n1 3\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n",
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{
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{
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"structure_string": "Zn4 W4 F20\n1.0\n10.513624 0.000000 0.000000\n0.000000 5.348463 0.000000\n0.000000 2.645118 7.621515\nZn W F\n4 4 20\ndirect\n0.986879 0.482174 0.778284 Zn\n0.486879 0.517826 0.721716 Zn\n0.013121 0.517826 0.221716 Zn\n0.513121 0.482174 0.278284 Zn\n0.756626 0.072934 0.621550 W\n0.256626 0.927066 0.878450 W\n0.243374 0.927066 0.378450 W\n0.743374 0.072934 0.121550 W\n0.886144 0.387573 0.596850 F\n0.386144 0.612427 0.903150 F\n0.113856 0.612427 0.403150 F\n0.613856 0.387573 0.096850 F\n0.601941 0.328373 0.511670 F\n0.101941 0.671627 0.988330 F\n0.398059 0.671627 0.488330 F\n0.898059 0.328373 0.011670 F\n0.416842 0.165258 0.778643 F\n0.916842 0.834742 0.721357 F\n0.583158 0.834742 0.221357 F\n0.083158 0.165258 0.278643 F\n0.137256 0.264469 0.831638 F\n0.637256 0.735531 0.668362 F\n0.862744 0.735531 0.168362 F\n0.362744 0.264469 0.331638 F\n0.688301 0.092277 0.864761 F\n0.188301 0.907723 0.635239 F\n0.311699 0.907723 0.135239 F\n0.811699 0.092277 0.364761 F\n",
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{
"id": "mp-26789",
"created_at": "2022-09-04T14:40:56.536841Z",
"structure_string": "Li4 Fe2 P4 O14\n1.0\n5.700310 0.000253 0.000061\n2.850475 6.479391 3.400747\n0.000086 0.128907 7.952684\nLi Fe P O\n4 2 4 14\ndirect\n0.049894 0.549858 0.809459 Li\n0.950080 0.450144 0.190531 Li\n0.400142 0.549900 0.309478 Li\n0.599839 0.450096 0.690540 Li\n0.999997 0.999993 0.000008 Fe\n0.000080 0.000003 0.499930 Fe\n0.755148 0.774491 0.360103 P\n0.244847 0.225510 0.639903 P\n0.470382 0.774577 0.860099 P\n0.529617 0.225420 0.139906 P\n0.887715 0.775350 0.528893 O\n0.510201 0.999954 0.249994 O\n0.304646 0.762383 0.714984 O\n0.742676 0.613047 0.924925 O\n0.663006 0.224601 0.971081 O\n0.933133 0.762269 0.215031 O\n0.695385 0.237613 0.284995 O\n0.336978 0.775385 0.028915 O\n0.489784 0.000049 0.750016 O\n0.355620 0.387033 0.575080 O\n0.066857 0.237718 0.784993 O\n0.112299 0.224680 0.471105 O\n0.257313 0.386947 0.075073 O\n0.644362 0.612976 0.424956 O\n",
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{
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"elements": [
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],
"chemical_system": "Fe-O",
"density": 4.582091167252546,
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"volume": 1241.3194350304952,
"volume_molar": 6.986355482128333,
"formula_full": "Fe43 O64",
"formula_reduced": "Fe43O64",
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"updated_at": "2021-11-28T01:35:01.242000Z",
"spacegroup": 5
},
{
"id": "mp-1202088",
"created_at": "2022-09-04T14:40:55.653315Z",
"structure_string": "Mg4 B8 H32\n1.0\n-4.189958 4.189958 5.332222\n4.189958 -4.189958 5.332222\n4.189958 4.189958 -5.332222\nMg B H\n4 8 32\ndirect\n0.750000 0.250000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.250000 0.750000 0.500000 Mg\n0.644124 0.409561 0.765437 B\n0.159561 0.894124 0.265437 B\n0.628687 0.894124 0.734563 B\n0.644124 0.878687 0.234563 B\n0.105876 0.840439 0.734563 B\n0.590439 0.355876 0.234563 B\n0.121313 0.355876 0.765437 B\n0.105876 0.371313 0.265437 B\n0.737752 0.450537 0.958167 H\n0.492371 0.450537 0.712785 H\n0.200537 0.987752 0.458167 H\n0.529586 0.987753 0.787215 H\n0.737752 0.779586 0.287215 H\n0.492371 0.779586 0.041833 H\n0.200537 0.742371 0.212785 H\n0.529586 0.742371 0.541833 H\n0.012247 0.799463 0.541833 H\n0.257629 0.799463 0.787215 H\n0.549463 0.262247 0.041833 H\n0.220414 0.262247 0.712785 H\n0.012247 0.470414 0.212785 H\n0.257629 0.470414 0.458167 H\n0.549463 0.507629 0.287215 H\n0.220414 0.507629 0.958167 H\n0.588199 0.950915 0.362716 H\n0.700915 0.838199 0.862716 H\n0.975484 0.838199 0.137284 H\n0.588199 0.225484 0.637284 H\n0.161801 0.299085 0.137284 H\n0.049085 0.411801 0.637284 H\n0.774516 0.411801 0.362716 H\n0.161801 0.024516 0.862716 H\n0.758486 0.511456 0.752970 H\n0.261456 0.008486 0.252970 H\n0.755516 0.008486 0.747030 H\n0.758486 0.005516 0.247030 H\n0.991514 0.738544 0.747030 H\n0.488544 0.241514 0.247030 H\n0.994484 0.241514 0.752970 H\n0.991514 0.244484 0.252970 H\n",
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"formula_full": "Mg4 B8 H32",
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"updated_at": "2021-11-28T01:35:24.100000Z",
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}
]
}