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{
"id": "jvasp-65614",
"created_at": "2022-09-04T14:36:19.478438Z",
"updated_at": "2022-09-04T14:36:19.478457Z",
"structure_string": "Ba1 Sr2 Ca1\n1.0\n4.201784 0.000000 -0.000000\n-0.000000 4.201784 -0.000000\n0.000000 -0.000000 11.664221\nBa Sr Ca\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.729627 Sr\n0.000000 0.000000 0.270373 Sr\n0.500000 0.500000 0.500000 Ca\n",
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{
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"structure_string": "Rb1 Sr1 Cl3\n1.0\n5.618110 -0.000000 0.000000\n0.000000 5.618110 0.000000\n-0.000000 -0.000000 5.618110\nRb Sr Cl\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Sr\n0.500000 0.000000 -0.000000 Cl\n-0.000000 0.500000 -0.000000 Cl\n0.000000 0.000000 0.500000 Cl\n",
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{
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"structure_string": "Rb3 Mg1\n1.0\n6.059902 -0.000000 3.498686\n2.019967 5.713331 3.498686\n-0.000000 0.000000 6.997372\nRb Mg\n3 1\ndirect\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n0.750000 0.750000 0.750001 Rb\n0.000000 0.000000 0.000000 Mg\n",
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{
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"created_at": "2022-09-04T14:36:00.779902Z",
"updated_at": "2022-09-04T14:36:00.779930Z",
"structure_string": "Na1 Zn4 As3\n1.0\n11.075426 -2.092482 0.001652\n11.075426 2.092482 0.001652\n10.679556 0.000000 3.604252\nNa Zn As\n1 4 3\ndirect\n0.500001 0.500001 0.499999 Na\n0.907604 0.907604 0.907601 Zn\n0.092398 0.092398 0.092397 Zn\n0.699715 0.699715 0.699713 Zn\n0.300286 0.300286 0.300285 Zn\n0.774950 0.774950 0.774948 As\n0.225051 0.225051 0.225050 As\n0.000000 0.000000 0.000000 As\n",
"nsites": 8,
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"volume": 166.9841802856427,
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"formula_full": "Na1 Zn4 As3",
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{
"id": "jvasp-103280",
"created_at": "2022-09-04T14:36:45.422835Z",
"updated_at": "2022-09-04T14:36:45.422858Z",
"structure_string": "Mg2 S2\n1.0\n4.032474 0.000000 0.000000\n-2.016237 3.492225 0.000000\n0.000000 0.000000 6.474185\nMg S\n2 2\ndirect\n0.333332 0.666666 0.997387 Mg\n0.666666 0.333333 0.497388 Mg\n0.666666 0.333333 0.877610 S\n0.333332 0.666666 0.377611 S\n",
"nsites": 4,
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{
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"created_at": "2022-09-04T14:36:14.522844Z",
"updated_at": "2022-09-04T14:36:14.522860Z",
"structure_string": "Na1 Zn4 As3\n1.0\n-2.092757 -3.624760 0.000000\n2.092757 -3.624760 0.000000\n-0.000000 -2.416507 11.004699\nNa Zn As\n1 4 3\ndirect\n0.500000 0.500000 0.500000 Na\n0.092386 0.092386 0.722842 Zn\n0.907614 0.907614 0.277158 Zn\n0.300308 0.300308 0.099078 Zn\n0.699693 0.699693 0.900922 Zn\n0.225039 0.225039 0.324885 As\n0.774962 0.774962 0.675115 As\n0.000000 0.000000 0.000000 As\n",
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{
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"created_at": "2022-09-04T14:36:36.605510Z",
"updated_at": "2022-09-04T14:36:36.605523Z",
"structure_string": "Ba1 Ca3\n1.0\n3.937736 0.005579 12.638858\n1.927924 3.433498 12.638858\n0.009516 0.005579 13.238067\nBa Ca\n1 3\ndirect\n0.000000 0.000000 0.000000 Ba\n0.245902 0.245903 0.245902 Ca\n0.500000 0.500001 0.500000 Ca\n0.754098 0.754099 0.754097 Ca\n",
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{
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"created_at": "2022-09-04T14:37:32.789218Z",
"updated_at": "2022-09-04T14:37:32.789236Z",
"structure_string": "K2 Hf1 F6\n1.0\n5.198041 0.000000 3.001090\n1.732680 4.900760 3.001090\n0.000000 0.000000 6.002181\nK Hf F\n2 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.000000 0.000000 0.000000 Hf\n0.235447 0.764553 0.764553 F\n0.235447 0.764553 0.235447 F\n0.764553 0.235447 0.764553 F\n0.764553 0.235447 0.235447 F\n0.764553 0.764553 0.235447 F\n0.235447 0.235447 0.764553 F\n",
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"spacegroup": 225
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{
"id": "jvasp-16477",
"created_at": "2022-09-04T14:37:38.691271Z",
"updated_at": "2022-09-04T14:37:38.691292Z",
"structure_string": "Li2 Cd1 Pb1\n1.0\n4.260722 0.000000 2.459930\n1.420240 4.017048 2.459930\n-0.000000 -0.000000 4.919859\nLi Cd Pb\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.500000 0.500000 0.500000 Li\n0.749999 0.750000 0.750000 Cd\n0.000000 0.000000 0.000000 Pb\n",
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{
"id": "jvasp-108756",
"created_at": "2022-09-04T14:38:27.864786Z",
"updated_at": "2022-09-04T14:38:27.864802Z",
"structure_string": "Li2 Zn1 Cu3\n1.0\n4.261714 -0.000955 2.492168\n1.429186 4.014926 2.492168\n-0.001354 -0.000955 4.936913\nLi Zn Cu\n2 1 3\ndirect\n0.122359 0.122359 0.122359 Li\n0.877642 0.877640 0.877641 Li\n0.500001 0.499999 0.500000 Zn\n0.500000 -0.000001 0.500000 Cu\n0.000001 0.500000 0.499999 Cu\n0.500000 0.500000 0.000000 Cu\n",
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{
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"created_at": "2022-09-04T14:37:04.291460Z",
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"structure_string": "Li2 Ag2 F6\n1.0\n-5.391203 -0.000000 0.000000\n-2.695601 -5.211107 -0.003288\n-2.695601 -1.397192 4.454959\nLi Ag F\n2 2 6\ndirect\n0.801298 0.596105 0.801298 Li\n0.301298 0.096105 0.301298 Li\n0.512671 0.461984 0.512672 Ag\n0.012671 0.961985 0.012671 Ag\n0.940059 0.244500 0.591291 F\n0.440059 0.744500 0.724149 F\n0.724148 0.744500 0.091291 F\n0.591291 0.244500 0.224149 F\n0.224149 0.244500 0.940060 F\n0.091291 0.744500 0.440060 F\n",
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{
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"created_at": "2022-09-04T14:36:49.697567Z",
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"structure_string": "Tl3 Cr1 F6\n1.0\n5.526392 -0.000000 3.190664\n1.842131 5.210332 3.190664\n-0.000000 -0.000000 6.381328\nTl Cr F\n3 1 6\ndirect\n0.250000 0.250000 0.250000 Tl\n0.750000 0.750000 0.750000 Tl\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Cr\n0.787113 0.212886 0.212886 F\n0.212886 0.787113 0.787114 F\n0.212886 0.787113 0.212886 F\n0.787113 0.212886 0.787114 F\n0.212886 0.212886 0.787114 F\n0.787113 0.787113 0.212886 F\n",
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