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{
"id": "jvasp-102436",
"created_at": "2022-09-04T14:38:45.365272Z",
"updated_at": "2022-09-04T14:38:45.365290Z",
"structure_string": "Li2 Mn1 Co1 O4\n1.0\n3.680911 0.120262 -3.463191\n-0.607049 3.632500 -3.463191\n-0.098506 -0.120262 5.053028\nLi Mn Co O\n2 1 1 4\ndirect\n0.249999 0.750000 0.500000 Li\n0.500000 0.500000 -0.000000 Li\n0.000000 0.000000 0.000000 Mn\n0.749999 0.250000 0.500000 Co\n0.519949 0.019950 0.500000 O\n0.227164 0.227164 -0.000000 O\n0.980049 0.480050 0.500000 O\n0.772836 0.772836 -0.000001 O\n",
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"structure_string": "Hf1 Ta2 V1 C4\n1.0\n3.119122 -0.000723 9.917444\n1.522189 2.722474 9.917444\n-0.001234 -0.000723 10.396376\nHf Ta V C\n1 2 1 4\ndirect\n0.003202 0.003202 0.003202 Hf\n0.496693 0.496694 0.496692 Ta\n0.248844 0.248845 0.248844 Ta\n0.751477 0.751478 0.751476 V\n0.623990 0.623990 0.623989 C\n0.873085 0.873086 0.873083 C\n0.380153 0.380153 0.380152 C\n0.122558 0.122558 0.122558 C\n",
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{
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"created_at": "2022-09-04T14:38:42.733368Z",
"updated_at": "2022-09-04T14:38:42.733385Z",
"structure_string": "Li4 Co2 Cu2 O8\n1.0\n3.634937 0.000328 -1.609577\n1.345327 7.234159 -1.869792\n0.068214 -0.037254 5.064207\nLi Co Cu O\n4 2 2 8\ndirect\n0.751557 0.874236 0.377290 Li\n0.751599 0.374229 0.877367 Li\n0.499497 0.750238 0.749266 Li\n0.499600 0.250193 0.249427 Li\n0.000390 0.499838 0.500588 Co\n0.000387 -0.000168 0.000574 Co\n0.249687 0.625162 0.124531 Cu\n0.249695 0.125168 0.624557 Cu\n0.015705 0.242114 0.273575 O\n0.015681 0.742119 0.773532 O\n0.483295 0.008325 0.974968 O\n0.483297 0.508311 0.474959 O\n0.225783 0.887107 0.338644 O\n0.225782 0.387139 0.838675 O\n0.774028 0.612993 0.161034 O\n0.774016 0.113002 0.661020 O\n",
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"volume": 133.78640324168967,
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"formula_full": "Li4 Co2 Cu2 O8",
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"spacegroup": 119
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{
"id": "jvasp-104914",
"created_at": "2022-09-04T14:38:42.564632Z",
"updated_at": "2022-09-04T14:38:42.564666Z",
"structure_string": "Ti1 Cu2 Ni1 O4\n1.0\n2.973515 0.024331 11.334278\n1.482512 2.577701 11.334278\n0.041668 0.024331 11.717760\nTi Cu Ni O\n1 2 1 4\ndirect\n0.000000 0.000000 0.000000 Ti\n0.752507 0.752503 0.752504 Cu\n0.247496 0.247495 0.247495 Cu\n0.500001 0.499999 0.500000 Ni\n0.195118 0.195117 0.195118 O\n0.698358 0.698355 0.698356 O\n0.804884 0.804881 0.804882 O\n0.301645 0.301643 0.301644 O\n",
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{
"id": "jvasp-110622",
"created_at": "2022-09-04T14:38:38.035275Z",
"updated_at": "2022-09-04T14:38:38.035293Z",
"structure_string": "Li2 Mn1 Fe1 O4\n1.0\n3.680559 -0.025487 -3.429283\n-0.713737 3.610781 -3.429283\n0.021090 0.025487 5.030511\nLi Mn Fe O\n2 1 1 4\ndirect\n0.249999 0.750000 0.500000 Li\n0.500000 0.499999 -0.000000 Li\n0.000000 0.000000 0.000000 Mn\n0.750000 0.250000 0.500000 Fe\n0.509703 0.009703 0.500000 O\n0.236508 0.236508 -0.000000 O\n0.990297 0.490297 0.500000 O\n0.763491 0.763491 -0.000000 O\n",
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{
"id": "jvasp-112492",
"created_at": "2022-09-04T14:38:40.712067Z",
"updated_at": "2022-09-04T14:38:40.712088Z",
"structure_string": "K2 P2 H4 O8\n1.0\n7.674986 -0.148438 0.000000\n-5.288816 5.563800 0.000000\n-0.000000 -0.000000 4.542016\nK P H O\n2 2 4 8\ndirect\n0.868752 0.131247 0.250000 K\n0.131247 0.868752 0.750001 K\n0.628399 0.371601 0.250000 P\n0.371601 0.628399 0.750001 P\n0.314763 0.314763 -0.000000 H\n0.685237 0.685237 0.500000 H\n0.689669 0.310331 0.750001 H\n0.310331 0.689669 0.250000 H\n0.360081 0.227493 0.163886 O\n0.227493 0.360081 0.836115 O\n0.639919 0.772506 0.663886 O\n0.772507 0.639919 0.336115 O\n0.612243 0.227745 0.506938 O\n0.227744 0.612243 0.493063 O\n0.387757 0.772255 0.006937 O\n0.772255 0.387757 0.993064 O\n",
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"formula_full": "K2 P2 H4 O8",
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"spacegroup": 20
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{
"id": "jvasp-26946",
"created_at": "2022-09-04T14:38:36.342802Z",
"updated_at": "2022-09-04T14:38:36.342831Z",
"structure_string": "Rb4 Li4 H16 N8\n1.0\n3.824168 -0.000000 0.000000\n0.000000 7.738761 0.000000\n0.000000 0.000000 11.401553\nRb Li H N\n4 4 16 8\ndirect\n0.750000 0.872015 0.741381 Rb\n0.250000 0.127985 0.258618 Rb\n0.750000 0.372015 0.758618 Rb\n0.250000 0.627985 0.241382 Rb\n0.750000 0.614413 0.000662 Li\n0.250000 0.385587 0.999338 Li\n0.750000 0.114413 0.499338 Li\n0.250000 0.885587 0.500662 Li\n0.958957 0.405800 0.429648 H\n0.458957 0.594200 0.570352 H\n0.541043 0.905800 0.070352 H\n0.041043 0.094200 0.929648 H\n0.041043 0.594200 0.570352 H\n0.541043 0.405800 0.429648 H\n0.458957 0.094200 0.929648 H\n0.958957 0.905800 0.070352 H\n0.250000 0.741192 0.936911 H\n0.750000 0.258808 0.063089 H\n0.250000 0.241192 0.563088 H\n0.750000 0.758808 0.436911 H\n0.250000 0.624189 0.818599 H\n0.750000 0.375811 0.181401 H\n0.250000 0.124189 0.681401 H\n0.750000 0.875811 0.318599 H\n0.750000 0.885621 0.409009 N\n0.250000 0.114379 0.590991 N\n0.750000 0.385621 0.090991 N\n0.250000 0.614379 0.909009 N\n0.750000 0.840991 0.107403 N\n0.250000 0.159009 0.892597 N\n0.750000 0.340991 0.392597 N\n0.250000 0.659009 0.607403 N\n",
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],
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{
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"created_at": "2022-09-04T14:38:38.450537Z",
"updated_at": "2022-09-04T14:38:38.450577Z",
"structure_string": "Li2 Mn1 Cr1 O4\n1.0\n3.704813 -0.031720 -3.571962\n-0.690789 3.639896 -3.572086\n0.026640 0.031718 5.146281\nLi Mn Cr O\n2 1 1 4\ndirect\n0.250016 0.750015 0.500005 Li\n0.500003 0.500010 0.000001 Li\n0.000001 0.000008 0.000009 Mn\n0.749996 0.250000 0.500001 Cr\n0.516601 0.016600 0.499992 O\n0.231174 0.231166 0.999995 O\n0.983385 0.483391 0.499995 O\n0.768822 0.768815 0.000002 O\n",
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},
{
"id": "jvasp-112370",
"created_at": "2022-09-04T14:38:39.443994Z",
"updated_at": "2022-09-04T14:38:39.444013Z",
"structure_string": "Er2 Lu2 B8 Ru4\n1.0\n5.259727 -0.000000 0.000000\n0.000000 5.845892 0.000000\n-0.000000 0.000000 6.321277\nEr Lu B Ru\n2 2 8 4\ndirect\n0.500000 0.489553 0.586646 Er\n0.500000 0.989553 0.413354 Er\n-0.000000 0.511195 0.914522 Lu\n-0.000000 0.011195 0.085478 Lu\n0.666433 0.131841 0.787185 B\n0.333568 0.631841 0.212816 B\n0.164748 0.867180 0.716110 B\n0.835253 0.367180 0.283891 B\n0.835253 0.867180 0.716110 B\n0.164748 0.367180 0.283891 B\n0.333568 0.131841 0.787185 B\n0.666433 0.631841 0.212816 B\n0.500000 0.316238 0.066610 Ru\n0.500000 0.816238 0.933390 Ru\n-0.000000 0.684969 0.432083 Ru\n-0.000000 0.184970 0.567918 Ru\n",
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"structure_string": "Cd2 In1 Ag1 S4\n1.0\n7.091648 0.002711 3.491015\n5.873652 3.973875 3.491015\n-0.037354 -0.011457 7.218946\nCd In Ag S\n2 1 1 4\ndirect\n0.494739 0.494738 0.175433 Cd\n0.004407 0.004406 0.648309 Cd\n0.753155 0.753152 0.599658 In\n0.246886 0.246885 0.072776 Ag\n0.061099 0.061098 0.263274 S\n0.566816 0.566813 0.770498 S\n0.817878 0.817874 0.855153 S\n0.302822 0.302820 0.366897 S\n",
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{
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"structure_string": "Ag2 Bi1 Sb1 Se4\n1.0\n5.322373 0.020124 -4.813091\n-1.035718 5.220666 -4.813091\n-0.016460 -0.020124 7.175878\nAg Bi Sb Se\n2 1 1 4\ndirect\n0.499999 0.500000 -0.000000 Ag\n0.250000 0.750001 0.500001 Ag\n0.749999 0.250000 0.500000 Bi\n0.000000 0.000000 0.000000 Sb\n0.497068 0.997069 0.500001 Se\n0.247196 0.247196 -0.000000 Se\n0.002931 0.502932 0.500001 Se\n0.752803 0.752804 -0.000000 Se\n",
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{
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"created_at": "2022-09-04T14:38:39.025786Z",
"updated_at": "2022-09-04T14:38:39.025806Z",
"structure_string": "K2 Ca1 Pr1 O4\n1.0\n3.629791 0.000000 0.000000\n0.000000 5.858998 1.865509\n0.000000 0.026954 6.536227\nK Ca Pr O\n2 1 1 4\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.500000 0.500000 Ca\n0.500000 -0.000000 0.500000 Pr\n0.500000 0.736001 0.301955 O\n0.000000 0.232503 0.300942 O\n0.500000 0.263998 0.698046 O\n0.000000 0.767496 0.699059 O\n",
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}