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{
"id": "jvasp-39992",
"created_at": "2022-09-04T14:38:01.674465Z",
"updated_at": "2022-09-04T14:38:01.674491Z",
"structure_string": "Er2 Hg6\n1.0\n3.293282 -5.704131 -0.000000\n3.293282 5.704131 0.000000\n-0.000000 0.000000 4.977574\nEr Hg\n2 6\ndirect\n0.333333 0.666667 0.749999 Er\n0.666667 0.333333 0.250000 Er\n0.167755 0.335510 0.250000 Hg\n0.664490 0.832244 0.250000 Hg\n0.167755 0.832244 0.250000 Hg\n0.832244 0.664490 0.749999 Hg\n0.335510 0.167755 0.749999 Hg\n0.832244 0.167755 0.749999 Hg\n",
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{
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"structure_string": "Rb1 Ag1 Br3\n1.0\n5.365890 0.004202 0.000114\n-0.004284 5.366010 0.007578\n-0.000139 -0.007727 5.365965\nRb Ag Br\n1 1 3\ndirect\n-0.000003 0.011788 0.001865 Rb\n0.500011 0.512080 0.502066 Ag\n0.000001 0.512006 0.501910 Br\n0.500040 0.012076 0.502110 Br\n0.499949 0.512048 0.002045 Br\n",
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{
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"structure_string": "Ge2 Cl2 F2\n1.0\n3.740865 -0.000000 -0.000000\n0.000000 3.740865 -0.000000\n0.000000 0.000000 7.353852\nGe Cl F\n2 2 2\ndirect\n0.500001 0.000000 0.806985 Ge\n0.000000 0.500001 0.193015 Ge\n0.000000 0.500001 0.657130 Cl\n0.500001 0.000000 0.342870 Cl\n0.000000 0.000000 0.000000 F\n0.500001 0.500001 0.000000 F\n",
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},
{
"id": "jvasp-16579",
"created_at": "2022-09-04T14:38:01.702865Z",
"updated_at": "2022-09-04T14:38:01.702890Z",
"structure_string": "Mn1 Zn3\n1.0\n3.812552 -0.000000 -0.000000\n-0.000000 3.812552 -0.000000\n0.000000 -0.000000 3.812552\nMn Zn\n1 3\ndirect\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n",
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"volume": 55.41755071842715,
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},
{
"id": "jvasp-23372",
"created_at": "2022-09-04T14:37:35.824314Z",
"updated_at": "2022-09-04T14:37:35.824335Z",
"structure_string": "Ca2 In8 Pd2\n1.0\n4.377666 0.000000 -1.174476\n0.000000 7.606844 -0.000000\n-0.005424 -0.000000 8.725537\nCa In Pd\n2 8 2\ndirect\n0.870550 0.250000 0.741098 Ca\n0.129452 0.750000 0.258902 Ca\n0.682140 0.047332 0.364278 In\n0.317861 0.952668 0.635723 In\n0.317861 0.547331 0.635723 In\n0.682140 0.452668 0.364278 In\n0.063110 0.250000 0.126219 In\n0.936892 0.750000 0.873781 In\n0.500000 0.000000 -0.000000 In\n0.500000 0.500000 -0.000000 In\n0.224992 0.250000 0.449982 Pd\n0.775010 0.750000 0.550019 Pd\n",
"nsites": 12,
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"elements": [
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"density": 6.925003419603155,
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"volume": 290.5138638709658,
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"formula_full": "Ca2 In8 Pd2",
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{
"id": "jvasp-37771",
"created_at": "2022-09-04T14:37:53.593027Z",
"updated_at": "2022-09-04T14:37:53.593049Z",
"structure_string": "Ho1 Tm1 Zn2\n1.0\n0.000000 3.514896 3.514896\n3.514896 -0.000000 3.514896\n3.514896 3.514896 0.000000\nHo Tm Zn\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ho\n0.750001 0.750001 0.750001 Tm\n0.000000 0.000000 0.000000 Zn\n0.500001 0.500001 0.500001 Zn\n",
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{
"id": "jvasp-25374",
"created_at": "2022-09-04T14:37:40.498629Z",
"updated_at": "2022-09-04T14:37:40.498650Z",
"structure_string": "K2\n1.0\n4.645041 0.000000 0.000000\n2.322520 4.006426 0.000000\n-0.000000 0.000000 7.561566\nK\n2\ndirect\n0.832145 0.335709 0.250000 K\n0.167855 0.664291 0.750000 K\n",
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{
"id": "jvasp-21974",
"created_at": "2022-09-04T14:37:35.047339Z",
"updated_at": "2022-09-04T14:37:35.047363Z",
"structure_string": "Rb2 Th1 F6\n1.0\n3.423156 -5.929081 0.000000\n3.423156 5.929081 -0.000000\n0.000000 0.000000 3.839451\nRb Th F\n2 1 6\ndirect\n0.333334 0.666668 0.500000 Rb\n0.666668 0.333334 0.500000 Rb\n0.000000 0.000000 0.000000 Th\n0.000000 0.221375 0.500000 F\n0.778626 0.778626 0.500000 F\n0.221375 0.000000 0.500000 F\n0.662507 0.000000 0.000000 F\n0.337494 0.337494 0.000000 F\n0.000000 0.662507 0.000000 F\n",
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"volume": 155.85229425942327,
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"formula_full": "Rb2 Th1 F6",
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"formula_anonymous": "AB2C6",
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"spacegroup": 189
},
{
"id": "jvasp-41323",
"created_at": "2022-09-04T14:37:40.517032Z",
"updated_at": "2022-09-04T14:37:40.517049Z",
"structure_string": "Na1 Sr2 In1\n1.0\n-0.000000 4.145443 4.145443\n4.145443 0.000000 4.145443\n4.145443 4.145443 -0.000000\nNa Sr In\n1 2 1\ndirect\n0.749998 0.749998 0.749998 Na\n0.000000 0.000000 0.000000 Sr\n0.500000 0.500000 0.500000 Sr\n0.249999 0.249999 0.249999 In\n",
"nsites": 4,
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"spacegroup": 225
},
{
"id": "jvasp-42006",
"created_at": "2022-09-04T14:37:40.531494Z",
"updated_at": "2022-09-04T14:37:40.531514Z",
"structure_string": "Pm2 Zn6\n1.0\n3.219207 -5.575830 -0.000000\n3.219207 5.575830 0.000000\n0.000000 -0.000000 4.418223\nPm Zn\n2 6\ndirect\n0.333333 0.666667 0.250000 Pm\n0.666667 0.333333 0.749999 Pm\n0.707579 0.853790 0.749999 Zn\n0.146211 0.292421 0.749999 Zn\n0.146211 0.853790 0.749999 Zn\n0.292421 0.146211 0.250000 Zn\n0.853790 0.707579 0.250000 Zn\n0.853790 0.146211 0.250000 Zn\n",
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},
{
"id": "jvasp-37685",
"created_at": "2022-09-04T14:38:01.869865Z",
"updated_at": "2022-09-04T14:38:01.869888Z",
"structure_string": "Sr6 Tm2\n1.0\n3.982975 -6.898714 0.000000\n3.982975 6.898714 0.000000\n0.000000 0.000000 6.464576\nSr Tm\n6 2\ndirect\n0.171594 0.828404 0.750001 Sr\n0.656809 0.828404 0.750001 Sr\n0.171595 0.343189 0.750001 Sr\n0.828404 0.171594 0.250000 Sr\n0.343189 0.171595 0.250000 Sr\n0.828404 0.656809 0.250000 Sr\n0.333333 0.666666 0.250000 Tm\n0.666666 0.333333 0.750001 Tm\n",
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},
{
"id": "jvasp-51574",
"created_at": "2022-09-04T14:37:50.034330Z",
"updated_at": "2022-09-04T14:37:50.034358Z",
"structure_string": "Rb8 Cu4 Cl12\n1.0\n4.187218 -0.000000 0.000000\n0.000000 12.472052 0.000000\n0.000000 0.000000 12.982358\nRb Cu Cl\n8 4 12\ndirect\n0.750000 0.328017 0.025834 Rb\n0.250000 0.171983 0.525834 Rb\n0.750000 0.828017 0.474166 Rb\n0.250000 0.513929 0.326926 Rb\n0.750000 0.986071 0.826926 Rb\n0.250000 0.671983 0.974166 Rb\n0.750000 0.486071 0.673074 Rb\n0.250000 0.013929 0.173074 Rb\n0.750000 0.744238 0.192118 Cu\n0.250000 0.255762 0.807882 Cu\n0.750000 0.244238 0.307882 Cu\n0.250000 0.755762 0.692118 Cu\n0.250000 0.138898 0.949883 Cl\n0.250000 0.936456 0.639353 Cl\n0.750000 0.361102 0.449883 Cl\n0.250000 0.638898 0.550117 Cl\n0.250000 0.774803 0.280350 Cl\n0.250000 0.436456 0.860647 Cl\n0.750000 0.861102 0.050117 Cl\n0.750000 0.063544 0.360647 Cl\n0.250000 0.274804 0.219650 Cl\n0.750000 0.725196 0.780350 Cl\n0.750000 0.225196 0.719650 Cl\n0.750000 0.563544 0.139353 Cl\n",
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}
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