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{
"id": "mp-865111",
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{
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"structure_string": "Na8 Zn8 P16 H8 Cl8 O56\n1.0\n8.019800 0.000000 0.000000\n0.000000 8.019800 0.000000\n0.000000 0.000000 22.606429\nNa Zn P H Cl O\n8 8 16 8 8 56\ndirect\n0.145238 0.854762 0.750000 Na\n0.854762 0.145238 0.250000 Na\n0.354762 0.354762 0.500000 Na\n0.645238 0.645238 0.000000 Na\n0.849372 0.150628 0.750000 Na\n0.150628 0.849372 0.250000 Na\n0.650628 0.650628 0.500000 Na\n0.349372 0.349372 0.000000 Na\n0.001321 0.508697 0.629697 Zn\n0.998679 0.491303 0.129697 Zn\n0.008697 0.498679 0.379697 Zn\n0.991303 0.501321 0.879697 Zn\n0.491303 0.998679 0.870303 Zn\n0.508697 0.001321 0.370303 Zn\n0.498679 0.008697 0.620303 Zn\n0.501321 0.991303 0.120303 Zn\n0.374110 0.640193 0.642951 P\n0.625890 0.359807 0.142951 P\n0.140193 0.125890 0.392951 P\n0.859807 0.874110 0.892951 P\n0.359807 0.625890 0.857049 P\n0.640193 0.374110 0.357049 P\n0.125890 0.140193 0.607049 P\n0.874110 0.859807 0.107049 P\n0.863202 0.874492 0.608915 P\n0.136798 0.125508 0.108915 P\n0.374492 0.636798 0.358915 P\n0.625508 0.363202 0.858915 P\n0.125508 0.136798 0.891085 P\n0.874492 0.863202 0.391085 P\n0.636798 0.374492 0.641085 P\n0.363202 0.625508 0.141085 P\n0.285729 0.838502 0.469822 H\n0.714271 0.161498 0.969822 H\n0.338502 0.214271 0.219822 H\n0.661498 0.785729 0.719822 H\n0.161498 0.714271 0.030178 H\n0.838502 0.285729 0.530178 H\n0.214271 0.338502 0.780178 H\n0.785729 0.661498 0.280178 H\n0.184569 0.783078 0.510525 Cl\n0.815431 0.216922 0.010525 Cl\n0.283078 0.315431 0.260525 Cl\n0.716922 0.684569 0.760525 Cl\n0.216922 0.815431 0.989475 Cl\n0.783078 0.184569 0.489475 Cl\n0.315431 0.283078 0.739475 Cl\n0.684569 0.716922 0.239475 Cl\n0.871146 0.897557 0.675711 O\n0.128854 0.102443 0.175711 O\n0.397557 0.628854 0.425711 O\n0.602443 0.371146 0.925711 O\n0.102443 0.128854 0.824289 O\n0.897557 0.871146 0.324289 O\n0.628854 0.397557 0.574289 O\n0.371146 0.602443 0.074289 O\n0.390407 0.614741 0.574705 O\n0.609593 0.385259 0.074705 O\n0.114741 0.109593 0.324705 O\n0.885259 0.890407 0.824705 O\n0.385259 0.609593 0.925295 O\n0.614741 0.390407 0.425295 O\n0.109593 0.114741 0.675295 O\n0.890407 0.885259 0.175295 O\n0.991762 0.011930 0.579784 O\n0.008238 0.988070 0.079784 O\n0.511930 0.508238 0.329784 O\n0.488070 0.491762 0.829784 O\n0.988070 0.008238 0.920216 O\n0.011930 0.991762 0.420216 O\n0.508238 0.511930 0.670216 O\n0.491762 0.488070 0.170216 O\n0.425133 0.812744 0.666750 O\n0.574867 0.187256 0.166750 O\n0.312744 0.074867 0.416750 O\n0.687256 0.925133 0.916750 O\n0.187256 0.574867 0.833250 O\n0.812744 0.425133 0.333250 O\n0.074867 0.312744 0.583250 O\n0.925133 0.687256 0.083250 O\n0.807266 0.411807 0.669758 O\n0.192734 0.588193 0.169758 O\n0.911807 0.692734 0.419758 O\n0.088193 0.307266 0.919758 O\n0.588193 0.192734 0.830242 O\n0.411807 0.807266 0.330242 O\n0.692734 0.911807 0.580242 O\n0.307266 0.088193 0.080242 O\n0.200832 0.599824 0.668240 O\n0.799168 0.400176 0.168240 O\n0.099824 0.299168 0.418240 O\n0.900176 0.700832 0.918240 O\n0.400176 0.799168 0.831760 O\n0.599824 0.200832 0.331760 O\n0.299168 0.099824 0.581760 O\n0.700832 0.900176 0.081760 O\n0.919641 0.703343 0.585287 O\n0.080359 0.296657 0.085287 O\n0.203343 0.580359 0.335287 O\n0.796657 0.419641 0.835287 O\n0.296657 0.080359 0.914713 O\n0.703343 0.919641 0.414713 O\n0.580359 0.203343 0.664713 O\n0.419641 0.796657 0.164713 O\n",
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"formula_full": "Na8 Zn8 P16 H8 Cl8 O56",
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"spacegroup": 92
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{
"id": "mp-1027",
"created_at": "2022-09-04T14:46:14.201174Z",
"structure_string": "Hf1 Rh3\n1.0\n3.952285 0.000000 0.000000\n0.000000 3.952285 0.000000\n0.000000 0.000000 3.952285\nHf Rh\n1 3\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500000 0.000000 0.500000 Rh\n0.000000 0.500000 0.500000 Rh\n0.500000 0.500000 0.000000 Rh\n",
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},
{
"id": "mp-1079523",
"created_at": "2022-09-04T14:46:14.632279Z",
"structure_string": "Co2 O8\n1.0\n6.476655 0.000000 0.000000\n0.000000 5.500213 0.000000\n0.000000 0.056702 5.515809\nCo O\n2 8\ndirect\n0.250000 0.675389 0.667965 Co\n0.750000 0.324611 0.332035 Co\n0.455362 0.808292 0.762065 O\n0.955362 0.191708 0.237935 O\n0.544638 0.191708 0.237935 O\n0.044638 0.808292 0.762065 O\n0.250000 0.679000 0.372104 O\n0.750000 0.321000 0.627896 O\n0.250000 0.396579 0.756478 O\n0.750000 0.603421 0.243522 O\n",
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{
"id": "mp-1211096",
"created_at": "2022-09-04T14:46:14.126181Z",
"structure_string": "Na16 H16 W8 O32\n1.0\n8.629954 0.000000 0.000000\n0.000000 10.607060 0.000000\n0.000000 0.000000 14.042059\nNa H W O\n16 16 8 32\ndirect\n0.262329 0.438849 0.142346 Na\n0.737671 0.561151 0.857654 Na\n0.237671 0.561151 0.642346 Na\n0.737671 0.938849 0.357654 Na\n0.762329 0.438849 0.357654 Na\n0.262329 0.061151 0.642346 Na\n0.762329 0.061151 0.857654 Na\n0.237671 0.938849 0.142346 Na\n0.165748 0.003133 0.436115 Na\n0.834252 0.996867 0.563885 Na\n0.334252 0.996867 0.936115 Na\n0.834252 0.503133 0.063885 Na\n0.665748 0.003133 0.063885 Na\n0.165748 0.496867 0.936115 Na\n0.665748 0.496867 0.563885 Na\n0.334252 0.503133 0.436115 Na\n0.216707 0.340086 0.308395 H\n0.783293 0.659914 0.691605 H\n0.283293 0.659914 0.808395 H\n0.783293 0.840086 0.191605 H\n0.716707 0.340086 0.191605 H\n0.216707 0.159914 0.808395 H\n0.716707 0.159914 0.691605 H\n0.283293 0.840086 0.308395 H\n0.464933 0.104946 0.207301 H\n0.535067 0.895054 0.792699 H\n0.035067 0.895054 0.707301 H\n0.535067 0.604946 0.292699 H\n0.964933 0.104946 0.292699 H\n0.464933 0.395054 0.707301 H\n0.964933 0.395054 0.792699 H\n0.035067 0.604946 0.207301 H\n0.012582 0.201733 0.027649 W\n0.987418 0.798267 0.972351 W\n0.487418 0.798267 0.527649 W\n0.987418 0.701733 0.472351 W\n0.512582 0.201733 0.472351 W\n0.012582 0.298267 0.527649 W\n0.512582 0.298267 0.972351 W\n0.487418 0.701733 0.027649 W\n0.357575 0.142882 0.397839 O\n0.642425 0.857118 0.602161 O\n0.142425 0.857118 0.897839 O\n0.642425 0.642882 0.102161 O\n0.857575 0.142882 0.102161 O\n0.357575 0.357118 0.897839 O\n0.857575 0.357118 0.602161 O\n0.142425 0.642882 0.397839 O\n0.186232 0.108598 0.048671 O\n0.813768 0.891402 0.951329 O\n0.313768 0.891402 0.548671 O\n0.813768 0.608598 0.451329 O\n0.686232 0.108598 0.451329 O\n0.186232 0.391402 0.548671 O\n0.686232 0.391402 0.951329 O\n0.313768 0.608598 0.048671 O\n0.460951 0.313884 0.096646 O\n0.539049 0.686116 0.903354 O\n0.039049 0.686116 0.596646 O\n0.539049 0.813884 0.403354 O\n0.960951 0.313884 0.403354 O\n0.460951 0.186116 0.596646 O\n0.960951 0.186116 0.903354 O\n0.039049 0.813884 0.096646 O\n0.049838 0.368804 0.057530 O\n0.950162 0.631196 0.942470 O\n0.450162 0.631196 0.557530 O\n0.950162 0.868804 0.442470 O\n0.549838 0.368804 0.442470 O\n0.049838 0.131196 0.557530 O\n0.549838 0.131196 0.942470 O\n0.450162 0.868804 0.057530 O\n",
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"formula_full": "Na16 H16 W8 O32",
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{
"id": "mp-863415",
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"structure_string": "Li6 Fe6 Si6 O24\n1.0\n5.098591 -6.936454 0.000000\n5.098591 6.936454 0.000000\n-4.338209 0.000000 7.435722\nLi Fe Si O\n6 6 6 24\ndirect\n0.540341 0.767441 0.942631 Li\n0.232559 0.057369 0.459659 Li\n0.057369 0.459659 0.232559 Li\n0.942631 0.540341 0.767441 Li\n0.767441 0.942631 0.540341 Li\n0.459659 0.232559 0.057369 Li\n0.109058 0.286343 0.873279 Fe\n0.126721 0.890942 0.713657 Fe\n0.713657 0.126721 0.890942 Fe\n0.286343 0.873279 0.109058 Fe\n0.873279 0.109058 0.286343 Fe\n0.890942 0.713657 0.126721 Fe\n0.215495 0.439214 0.611034 Si\n0.560786 0.388966 0.784505 Si\n0.388966 0.784505 0.560786 Si\n0.611034 0.215495 0.439214 Si\n0.439214 0.611034 0.215495 Si\n0.784505 0.560786 0.388966 Si\n0.019923 0.049334 0.704373 O\n0.295627 0.980077 0.950666 O\n0.114424 0.434863 0.742399 O\n0.257601 0.885576 0.565137 O\n0.075916 0.343718 0.400033 O\n0.351748 0.650867 0.666444 O\n0.565137 0.257601 0.885576 O\n0.349133 0.333556 0.648252 O\n0.656282 0.599967 0.924084 O\n0.599967 0.924084 0.656282 O\n0.333556 0.648252 0.349133 O\n0.950666 0.295627 0.980077 O\n0.049334 0.704373 0.019923 O\n0.666444 0.351748 0.650867 O\n0.400033 0.075916 0.343718 O\n0.343718 0.400033 0.075916 O\n0.650867 0.666444 0.351748 O\n0.434863 0.742399 0.114424 O\n0.648252 0.349133 0.333555 O\n0.924084 0.656282 0.599967 O\n0.742399 0.114424 0.434863 O\n0.885576 0.565137 0.257601 O\n0.704373 0.019923 0.049334 O\n0.980077 0.950666 0.295627 O\n",
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{
"id": "mp-862682",
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"structure_string": "Ba2 Ga2 O5\n1.0\n3.998199 0.000000 0.000000\n0.000000 3.998199 0.000000\n0.000000 0.000000 8.298288\nBa Ga O\n2 2 5\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Ba\n0.500000 0.500000 0.271258 Ga\n0.500000 0.500000 0.728742 Ga\n0.500000 0.000000 0.229651 O\n0.500000 0.000000 0.770349 O\n0.000000 0.500000 0.229651 O\n0.000000 0.500000 0.770349 O\n0.500000 0.500000 0.500000 O\n",
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{
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