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{
"id": "jvasp-14003",
"created_at": "2022-09-04T14:38:04.249858Z",
"updated_at": "2022-09-04T14:38:04.249892Z",
"structure_string": "Li1 Sc1 Mo3 O8\n1.0\n2.879834 -4.988019 -0.000000\n2.879834 4.988019 0.000000\n0.000000 -0.000000 4.965391\nLi Sc Mo O\n1 1 3 8\ndirect\n0.666666 0.333332 0.303300 Li\n0.333332 0.666666 0.272822 Sc\n0.293543 0.146771 0.747873 Mo\n0.853227 0.706456 0.747873 Mo\n0.853228 0.146771 0.747873 Mo\n0.666666 0.333332 0.942987 O\n0.167659 0.335319 0.989513 O\n0.664680 0.832339 0.989513 O\n0.167659 0.832340 0.989513 O\n0.000000 0.000000 0.462976 O\n0.505980 0.011960 0.517917 O\n0.988038 0.494019 0.517917 O\n0.505980 0.494019 0.517917 O\n",
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{
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"structure_string": "Li4 Mn3 O1 F11\n1.0\n5.459445 -0.177079 0.072771\n-1.173498 6.203201 -0.252591\n-0.833656 -1.925991 6.258242\nLi Mn O F\n4 3 1 11\ndirect\n0.160177 0.558331 0.340467 Li\n0.371159 0.622925 0.886992 Li\n0.610955 0.361398 0.100238 Li\n0.844455 0.449448 0.649370 Li\n0.715621 0.870559 0.414314 Mn\n-0.003322 -0.002834 0.019787 Mn\n0.286208 0.135740 0.552710 Mn\n0.017271 0.961536 0.311740 O\n0.639620 0.156001 0.424506 F\n0.335726 0.129100 0.085082 F\n0.813087 0.606362 0.442880 F\n0.547733 0.351139 0.798928 F\n0.400258 0.854204 0.554044 F\n0.187886 0.417010 0.565329 F\n0.657216 0.863541 -0.060801 F\n0.934714 0.291854 0.119458 F\n0.051931 0.703820 0.895843 F\n0.434421 0.610630 0.172922 F\n0.994863 0.059232 0.726185 F\n",
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{
"id": "jvasp-112430",
"created_at": "2022-09-04T14:38:40.150379Z",
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"structure_string": "Cr4 O4 F4\n1.0\n3.015947 0.000002 -0.000000\n-0.000010 11.243298 0.000002\n0.000000 0.000003 3.883137\nCr O F\n4 4 4\ndirect\n0.250000 0.577381 0.250000 Cr\n0.750001 0.422620 0.750001 Cr\n0.250000 0.077379 0.250000 Cr\n0.750001 0.922620 0.750000 Cr\n0.750000 0.460563 0.250000 O\n0.750001 0.960563 0.250000 O\n0.250001 0.039437 0.750000 O\n0.250001 0.539437 0.750000 O\n0.750001 0.188271 0.250001 F\n0.750000 0.688272 0.250000 F\n0.250000 0.311728 0.750000 F\n0.250000 0.811729 0.750001 F\n",
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{
"id": "jvasp-71700",
"created_at": "2022-09-04T14:36:20.855135Z",
"updated_at": "2022-09-04T14:36:20.855157Z",
"structure_string": "Be1 Fe1 Cu2\n1.0\n-1.847590 1.847590 3.214284\n1.847590 -1.847590 3.214284\n1.847590 1.847590 -3.214284\nBe Fe Cu\n1 1 2\ndirect\n0.750000 0.250000 0.500000 Be\n0.499999 0.499999 0.000000 Fe\n0.000000 0.000000 0.000000 Cu\n0.250000 0.750000 0.500000 Cu\n",
"nsites": 4,
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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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{
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"created_at": "2022-09-04T14:35:42.519312Z",
"updated_at": "2022-09-04T14:35:42.519341Z",
"structure_string": "Li1 Be1 Cu2\n1.0\n-1.716564 1.716564 3.723509\n1.716564 -1.716564 3.723509\n1.716564 1.716564 -3.723509\nLi Be Cu\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Li\n0.749999 0.250000 0.499999 Be\n0.000000 0.000000 0.000000 Cu\n0.250000 0.749999 0.499999 Cu\n",
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{
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"created_at": "2022-09-04T14:38:26.373781Z",
"updated_at": "2022-09-04T14:38:26.373804Z",
"structure_string": "Li3 Ti3 Co3 F18\n1.0\n8.624911 -0.000000 0.000000\n-4.312455 7.469393 0.000000\n-0.000000 -0.000000 4.598238\nLi Ti Co F\n3 3 3 18\ndirect\n0.683268 0.000000 0.500000 Li\n0.000000 0.683268 0.500000 Li\n0.316732 0.316732 0.500000 Li\n0.338882 0.000000 -0.000000 Ti\n0.000000 0.338882 -0.000000 Ti\n0.661118 0.661118 -0.000000 Ti\n0.333334 0.666666 0.497672 Co\n0.666667 0.333333 0.502329 Co\n0.000000 0.000000 0.000000 Co\n0.122078 0.886826 0.244079 F\n0.772356 0.561727 0.249363 F\n0.210629 0.438273 0.750638 F\n0.789371 0.227644 0.249363 F\n0.438273 0.210629 0.249363 F\n0.886826 0.122078 0.755922 F\n0.877922 0.764748 0.755922 F\n0.235252 0.113174 0.755922 F\n0.554260 0.450390 0.752437 F\n0.113174 0.235252 0.244079 F\n0.896130 0.445740 0.752437 F\n0.227644 0.789371 0.750638 F\n0.445740 0.896130 0.247563 F\n0.549610 0.103870 0.752437 F\n0.450390 0.554260 0.247563 F\n0.103870 0.549610 0.247563 F\n0.764748 0.877922 0.244079 F\n0.561727 0.772356 0.750638 F\n",
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"formula_full": "Li3 Ti3 Co3 F18",
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{
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"created_at": "2022-09-04T14:37:00.480283Z",
"updated_at": "2022-09-04T14:37:00.480304Z",
"structure_string": "Mg1 C1 N2\n1.0\n3.107277 0.009008 4.053820\n1.381328 2.783376 4.053820\n0.014480 0.009008 5.107683\nMg C N\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500002 0.499998 C\n0.413618 0.413619 0.413617 N\n0.586382 0.586384 0.586380 N\n",
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{
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"updated_at": "2022-09-04T14:38:46.978262Z",
"structure_string": "Ni6 O1 F11\n1.0\n10.302273 0.040861 0.000000\n-8.202354 6.233771 0.000000\n-0.000000 -0.000000 3.058935\nNi O F\n6 1 11\ndirect\n0.000241 0.999759 -0.000000 Ni\n0.493160 0.506839 0.500001 Ni\n0.169355 0.830645 0.500001 Ni\n0.341374 0.658626 -0.000000 Ni\n0.664206 0.335793 -0.000000 Ni\n0.832306 0.167693 0.500001 Ni\n0.398114 0.601885 0.500001 O\n0.028976 0.363824 -0.000000 F\n0.730744 0.269256 0.500001 F\n0.270773 0.729227 0.500001 F\n0.597774 0.402226 0.500001 F\n0.698125 0.697506 -0.000000 F\n0.302494 0.301875 -0.000000 F\n0.636176 0.971024 -0.000000 F\n0.364934 0.029332 -0.000000 F\n0.066790 0.933210 0.500001 F\n0.970668 0.635066 -0.000000 F\n0.934042 0.065958 0.500001 F\n",
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"structure_string": "Be2 Pd1 Rh1\n1.0\n-0.000000 2.799550 2.799550\n2.799550 -0.000000 2.799550\n2.799550 2.799550 0.000000\nBe Pd Rh\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Be\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Pd\n0.750000 0.750000 0.750000 Rh\n",
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{
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"created_at": "2022-09-04T14:37:17.172325Z",
"updated_at": "2022-09-04T14:37:17.172341Z",
"structure_string": "Ni2 F4\n1.0\n3.117311 0.000000 0.000000\n0.000000 4.592125 0.000000\n0.000000 0.000000 4.598154\nNi F\n2 4\ndirect\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500001 0.500000 Ni\n0.000000 0.301013 0.301832 F\n0.500000 0.198988 0.801832 F\n0.000000 0.698988 0.698167 F\n0.500000 0.801013 0.198167 F\n",
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{
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"structure_string": "Zn1 O2\n1.0\n-1.560763 -2.703595 0.000721\n-1.560997 2.703730 -0.000001\n0.000624 0.000362 -3.899361\nZn O\n1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.333600 0.666800 0.242660 O\n0.666400 0.333201 0.757340 O\n",
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