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{
"id": "mp-1185055",
"created_at": "2022-09-04T14:48:25.178500Z",
"structure_string": "Hf8 In4 Ni8\n1.0\n7.201666 0.000000 0.000000\n0.000000 7.201666 0.000000\n0.000000 0.000000 6.550820\nHf In Ni\n8 4 8\ndirect\n0.174551 0.174551 0.000000 Hf\n0.825449 0.825449 0.000000 Hf\n0.325449 0.674551 0.500000 Hf\n0.674551 0.325449 0.500000 Hf\n0.657983 0.342017 0.000000 Hf\n0.342017 0.657983 0.000000 Hf\n0.842017 0.842017 0.500000 Hf\n0.157983 0.157983 0.500000 Hf\n0.500000 0.000000 0.250000 In\n0.000000 0.500000 0.250000 In\n0.000000 0.500000 0.750000 In\n0.500000 0.000000 0.750000 In\n0.373996 0.373996 0.270386 Ni\n0.626004 0.626004 0.270386 Ni\n0.126004 0.873996 0.229614 Ni\n0.873996 0.126004 0.229614 Ni\n0.626004 0.626004 0.729614 Ni\n0.373996 0.373996 0.729614 Ni\n0.126004 0.873996 0.770386 Ni\n0.873996 0.126004 0.770386 Ni\n",
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{
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{
"id": "mp-15734",
"created_at": "2022-09-04T14:48:13.568669Z",
"structure_string": "K4 Mn16 P12 O48\n1.0\n6.449438 0.000000 0.000000\n0.000000 10.029314 0.000000\n0.000000 0.000000 16.889587\nK Mn P O\n4 16 12 48\ndirect\n0.500000 0.788170 0.035527 K\n0.000000 0.711830 0.535527 K\n0.000000 0.288170 0.464473 K\n0.500000 0.211830 0.964473 K\n0.252340 0.247281 0.201357 Mn\n0.752340 0.252719 0.701357 Mn\n0.747660 0.247281 0.201357 Mn\n0.747660 0.752719 0.798643 Mn\n0.500000 0.476765 0.361162 Mn\n0.500000 0.523235 0.638838 Mn\n0.000000 0.976765 0.138838 Mn\n0.000000 0.023235 0.861162 Mn\n0.500000 0.040497 0.403982 Mn\n0.500000 0.959503 0.596018 Mn\n0.000000 0.540497 0.096018 Mn\n0.000000 0.459503 0.903982 Mn\n0.252340 0.752719 0.798643 Mn\n0.247660 0.747281 0.298643 Mn\n0.247660 0.252719 0.701357 Mn\n0.752340 0.747281 0.298643 Mn\n0.500000 0.715982 0.463906 P\n0.500000 0.284018 0.536094 P\n0.000000 0.215982 0.036094 P\n0.000000 0.784018 0.963906 P\n0.000000 0.458131 0.285686 P\n0.000000 0.541869 0.714314 P\n0.500000 0.958131 0.214314 P\n0.500000 0.459136 0.831530 P\n0.500000 0.041869 0.785686 P\n0.000000 0.959136 0.668470 P\n0.500000 0.540864 0.168470 P\n0.000000 0.040864 0.331530 P\n0.500000 0.869524 0.478005 O\n0.500000 0.130476 0.521995 O\n0.000000 0.369524 0.021995 O\n0.000000 0.630476 0.978005 O\n0.801878 0.591814 0.673131 O\n0.801878 0.408186 0.326869 O\n0.698122 0.091814 0.826869 O\n0.698122 0.908186 0.173131 O\n0.198122 0.408186 0.326869 O\n0.198122 0.591814 0.673131 O\n0.301878 0.908186 0.173131 O\n0.301878 0.091814 0.826869 O\n0.306682 0.327392 0.586104 O\n0.306682 0.672608 0.413896 O\n0.193318 0.827392 0.913896 O\n0.193318 0.172608 0.086104 O\n0.693318 0.672608 0.413896 O\n0.693318 0.327392 0.586104 O\n0.806682 0.172608 0.086104 O\n0.195372 0.916664 0.623373 O\n0.806682 0.827392 0.913896 O\n0.500000 0.648138 0.544835 O\n0.000000 0.851862 0.044835 O\n0.000000 0.148138 0.955165 O\n0.000000 0.112077 0.246500 O\n0.000000 0.887923 0.753500 O\n0.500000 0.612077 0.253500 O\n0.500000 0.387923 0.746500 O\n0.500000 0.893261 0.300481 O\n0.500000 0.106739 0.699519 O\n0.000000 0.393261 0.199519 O\n0.000000 0.606739 0.800481 O\n0.500000 0.613898 0.815623 O\n0.500000 0.386102 0.184377 O\n0.000000 0.113898 0.684377 O\n0.000000 0.886102 0.315623 O\n0.500000 0.886780 0.775314 O\n0.500000 0.113220 0.224686 O\n0.000000 0.386780 0.724686 O\n0.000000 0.613220 0.275314 O\n0.695372 0.416664 0.876627 O\n0.695372 0.583336 0.123373 O\n0.804628 0.916664 0.623373 O\n0.804628 0.083336 0.376627 O\n0.304628 0.583336 0.123373 O\n0.304628 0.416664 0.876627 O\n0.195372 0.083336 0.376627 O\n0.500000 0.351862 0.455165 O\n",
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"formula_full": "K4 Mn16 P12 O48",
"formula_reduced": "KMn4(PO4)3",
"formula_anonymous": "AB3C4D12",
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"spacegroup": 58
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{
"id": "mp-1233338",
"created_at": "2022-09-04T14:48:13.605058Z",
"structure_string": "K12 Mg1 Pb4 O10\n1.0\n6.381882 0.038384 0.690324\n0.207665 8.350328 1.183920\n0.062724 -0.458198 12.344745\nK Mg Pb O\n12 1 4 10\ndirect\n0.403848 0.613961 0.360454 K\n0.514850 0.462416 0.620608 K\n0.909019 0.451092 0.369070 K\n0.996683 0.594843 0.625159 K\n0.318805 0.927286 0.116234 K\n0.757472 0.946759 0.886616 K\n0.339322 0.467857 0.078268 K\n0.784331 0.535973 0.899664 K\n0.772655 0.698571 0.140468 K\n0.124276 0.233181 0.900638 K\n0.385340 0.169238 0.361536 K\n0.590112 0.947214 0.610077 K\n0.566211 0.273254 0.828759 Mg\n0.893430 0.881768 0.361815 Pb\n0.104536 0.177513 0.640616 Pb\n0.771482 0.190012 0.137792 Pb\n0.327327 0.728617 0.845769 Pb\n0.640175 0.970244 0.241616 O\n0.392655 0.163131 0.734159 O\n0.590763 0.195892 0.990353 O\n0.516225 0.734922 0.987090 O\n0.717686 0.700836 0.473077 O\n0.203094 0.372795 0.515352 O\n0.605304 0.376183 0.228088 O\n0.384898 0.465476 0.847504 O\n0.073762 0.716491 0.261705 O\n0.857404 0.312810 0.750011 O\n",
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{
"id": "mp-1106068",
"created_at": "2022-09-04T14:48:26.727610Z",
"structure_string": "La1 Cr4 Cu3 O12\n1.0\n-3.720152 3.727447 -3.726259\n3.720133 -3.727465 -3.726258\n-3.720134 -3.727446 -3.726277\nLa Cr Cu O\n1 4 3 12\ndirect\n0.000000 0.000000 0.000000 La\n0.000000 0.500000 0.000000 Cr\n0.500000 0.500000 0.500000 Cr\n0.500000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 Cr\n0.500000 0.500000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.000000 0.500000 0.500000 Cu\n0.858876 0.689156 0.830280 O\n0.480564 0.310844 0.830280 O\n0.519436 0.689156 0.169720 O\n0.141124 0.310844 0.169720 O\n0.830854 0.141651 0.689204 O\n0.830853 0.520057 0.310796 O\n0.169147 0.479943 0.689204 O\n0.169146 0.858349 0.310796 O\n0.311091 0.169686 0.519223 O\n0.688909 0.169686 0.141406 O\n0.311091 0.830314 0.858594 O\n0.688908 0.830314 0.480777 O\n",
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{
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"structure_string": "Zr18 Mo8 S2\n1.0\n4.381616 -7.589181 0.000000\n4.381616 7.589181 0.000000\n0.000000 0.000000 8.654439\nZr Mo S\n18 8 2\ndirect\n0.538308 0.076617 0.250000 Zr\n0.461692 0.923383 0.750000 Zr\n0.923383 0.461692 0.250000 Zr\n0.076617 0.538308 0.750000 Zr\n0.538308 0.461692 0.250000 Zr\n0.461692 0.538308 0.750000 Zr\n0.198298 0.396595 0.047986 Zr\n0.801702 0.603405 0.952014 Zr\n0.603405 0.801702 0.047986 Zr\n0.801702 0.603405 0.547986 Zr\n0.396595 0.198298 0.952014 Zr\n0.198298 0.396595 0.452014 Zr\n0.198298 0.801702 0.047986 Zr\n0.396595 0.198298 0.547986 Zr\n0.801702 0.198298 0.952014 Zr\n0.603405 0.801702 0.452014 Zr\n0.801702 0.198298 0.547986 Zr\n0.198298 0.801702 0.452014 Zr\n0.000000 0.000000 0.000000 Mo\n0.000000 0.000000 0.500000 Mo\n0.891381 0.782763 0.250000 Mo\n0.108619 0.217237 0.750000 Mo\n0.217237 0.108619 0.250000 Mo\n0.782763 0.891381 0.750000 Mo\n0.891381 0.108619 0.250000 Mo\n0.108619 0.891381 0.750000 Mo\n0.333333 0.666667 0.250000 S\n0.666667 0.333333 0.750000 S\n",
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{
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"structure_string": "Mn8 O13 F3\n1.0\n4.997478 0.000000 0.000000\n-0.008570 7.089522 0.000000\n-0.018148 -1.447343 6.999834\nMn O F\n8 13 3\ndirect\n0.710616 0.071960 0.436215 Mn\n0.259152 0.427084 0.070950 Mn\n0.775000 0.080654 0.938229 Mn\n0.263269 0.434235 0.578430 Mn\n0.742748 0.583325 0.416116 Mn\n0.259102 0.917484 0.077463 Mn\n0.226483 0.922705 0.581763 Mn\n0.759385 0.571183 0.925008 Mn\n0.094285 0.173095 0.059870 O\n0.581998 0.060862 0.175218 O\n0.903942 0.062915 0.675347 O\n0.437099 0.667233 0.060784 O\n0.934374 0.561589 0.166633 O\n0.399001 0.174205 0.558807 O\n0.423900 0.437005 0.326893 O\n0.070147 0.666370 0.556003 O\n0.581995 0.560923 0.671595 O\n0.548675 0.833685 0.438086 O\n0.590549 0.326522 0.938373 O\n0.089001 0.439138 0.826670 O\n0.935176 0.827659 0.932862 O\n0.924486 0.314464 0.440525 F\n0.033527 0.940831 0.323596 F\n0.456087 0.944874 0.824565 F\n",
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{
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"structure_string": "Rb4 Na8 C4\n1.0\n7.948930 0.000000 0.000000\n0.000000 7.948930 0.000000\n0.000000 0.000000 7.948930\nRb Na C\n4 8 4\ndirect\n0.500000 0.500000 0.500000 Rb\n0.000000 0.500000 0.000000 Rb\n0.500000 0.000000 0.000000 Rb\n0.000000 0.000000 0.500000 Rb\n0.238690 0.238690 0.238690 Na\n0.761310 0.761310 0.761310 Na\n0.261310 0.761310 0.738690 Na\n0.761310 0.738690 0.261310 Na\n0.738690 0.238690 0.261310 Na\n0.238690 0.261310 0.738690 Na\n0.738690 0.261310 0.761310 Na\n0.261310 0.738690 0.238690 Na\n0.000000 0.000000 0.000000 C\n0.500000 0.000000 0.500000 C\n0.000000 0.500000 0.500000 C\n0.500000 0.500000 0.000000 C\n",
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{
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{
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{
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"elements": [
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"chemical_system": "O-Te-W-Zn",
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"formula_full": "Zn4 Te2 W2 O12",
"formula_reduced": "Zn2TeWO6",
"formula_anonymous": "ABC2D6",
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{
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"updated_at": "2021-11-28T01:39:17.023000Z",
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}