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{
"id": "jvasp-91682",
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{
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{
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{
"id": "jvasp-97809",
"created_at": "2022-09-04T14:37:41.312200Z",
"updated_at": "2022-09-04T14:37:41.312211Z",
"structure_string": "Zn6 B14 Cl2 O26\n1.0\n7.441320 -0.004019 4.310332\n2.482598 7.014981 4.310332\n-0.005689 -0.004019 8.599545\nZn B Cl O\n6 14 2 26\ndirect\n0.471649 0.472979 0.034311 Zn\n0.472980 0.034311 0.471648 Zn\n0.972980 0.971648 0.534310 Zn\n0.534311 0.972979 0.971648 Zn\n0.971649 0.534311 0.972979 Zn\n0.034311 0.471648 0.472979 Zn\n0.747423 0.747827 0.253869 B\n0.747828 0.253869 0.747422 B\n0.253870 0.747423 0.747827 B\n0.753870 0.247827 0.247423 B\n0.573519 0.573586 0.267179 B\n0.247423 0.753869 0.247827 B\n0.073519 0.767179 0.073586 B\n0.073586 0.073519 0.767179 B\n0.602627 0.602626 0.602626 B\n0.102627 0.102627 0.102627 B\n0.573586 0.267179 0.573519 B\n0.267179 0.573519 0.573586 B\n0.247828 0.247423 0.753869 B\n0.767179 0.073586 0.073519 B\n0.266525 0.266525 0.266525 Cl\n0.766525 0.766525 0.766524 Cl\n0.935745 0.701382 0.254445 O\n0.435745 0.754445 0.201382 O\n0.201382 0.435745 0.754445 O\n0.191170 0.610367 0.434500 O\n0.110367 0.691169 0.934500 O\n0.934500 0.110367 0.691169 O\n0.691170 0.934500 0.110367 O\n0.754445 0.201382 0.435744 O\n0.701382 0.254445 0.935744 O\n0.445087 0.605382 0.765306 O\n0.605382 0.765306 0.445087 O\n0.765306 0.445087 0.605381 O\n0.265306 0.105382 0.945087 O\n0.105382 0.945087 0.265306 O\n0.945087 0.265306 0.105381 O\n0.989032 0.989031 0.989030 O\n0.750834 0.598679 0.214575 O\n0.598679 0.214576 0.750834 O\n0.214576 0.750834 0.598678 O\n0.098679 0.250834 0.714575 O\n0.250834 0.714576 0.098679 O\n0.714576 0.098679 0.250834 O\n0.610367 0.434500 0.191169 O\n0.434500 0.191169 0.610367 O\n0.254445 0.935745 0.701382 O\n0.489031 0.489031 0.489031 O\n",
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"formula_full": "Zn6 B14 Cl2 O26",
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{
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"created_at": "2022-09-04T14:37:29.766203Z",
"updated_at": "2022-09-04T14:37:29.766222Z",
"structure_string": "Rb2 Na1 Ti1 F6\n1.0\n5.222382 -0.000000 3.015143\n1.740794 4.923709 3.015143\n0.000000 0.000000 6.030287\nRb Na Ti F\n2 1 1 6\ndirect\n0.749999 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.499999 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Ti\n0.233330 0.766669 0.766669 F\n0.233330 0.766669 0.233331 F\n0.766668 0.233331 0.766669 F\n0.233331 0.233331 0.766669 F\n0.766668 0.233331 0.233331 F\n0.766668 0.766669 0.233331 F\n",
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{
"id": "jvasp-106171",
"created_at": "2022-09-04T14:36:03.441613Z",
"updated_at": "2022-09-04T14:36:03.441642Z",
"structure_string": "Fe2 F6\n1.0\n4.495109 0.080823 2.942752\n1.632063 4.189142 2.942752\n0.115977 0.080823 5.371437\nFe F\n2 6\ndirect\n0.500000 0.499999 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n0.250001 0.615884 0.884116 F\n0.884116 0.249999 0.615885 F\n0.615885 0.884114 0.250000 F\n0.750000 0.384114 0.115885 F\n0.115885 0.749999 0.384115 F\n0.384116 0.115884 0.750000 F\n",
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{
"id": "jvasp-69904",
"created_at": "2022-09-04T14:35:54.607922Z",
"updated_at": "2022-09-04T14:35:54.607948Z",
"structure_string": "Be2 Se1 Br1\n1.0\n-1.673163 1.673163 6.884220\n1.673163 -1.673163 6.884220\n1.673163 1.673163 -6.884220\nBe Se Br\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.749999 0.499999 Be\n0.749999 0.250000 0.499999 Se\n0.500000 0.500000 0.000000 Br\n",
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{
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"created_at": "2022-09-04T14:35:48.755650Z",
"updated_at": "2022-09-04T14:35:48.755670Z",
"structure_string": "Be1 Ga1 P2\n1.0\n2.632499 0.000000 -0.000000\n0.000000 2.632499 0.000000\n0.000000 0.000000 8.846025\nBe Ga P\n1 1 2\ndirect\n0.000000 0.000000 0.491539 Be\n0.500000 0.500000 0.707201 Ga\n0.000000 0.000000 0.974875 P\n0.500000 0.500000 0.326388 P\n",
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{
"id": "jvasp-9621",
"created_at": "2022-09-04T14:38:11.635992Z",
"updated_at": "2022-09-04T14:38:11.636018Z",
"structure_string": "Sc4 O4 F4\n1.0\n0.000000 5.190414 -0.012600\n5.174846 0.000000 0.000000\n0.000000 -0.884223 -5.186172\nSc O F\n4 4 4\ndirect\n0.307913 0.527346 0.712920 Sc\n0.692087 0.027346 0.787079 Sc\n0.692086 0.472654 0.287079 Sc\n0.307913 0.972655 0.212920 Sc\n0.455484 0.254111 0.987902 O\n0.544516 0.754111 0.512097 O\n0.544515 0.745890 0.012098 O\n0.455484 0.245890 0.487902 O\n0.058941 0.670106 0.337114 F\n0.941059 0.170106 0.162886 F\n0.941059 0.329894 0.662886 F\n0.058941 0.829895 0.837113 F\n",
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{
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"created_at": "2022-09-04T14:36:13.421364Z",
"updated_at": "2022-09-04T14:36:13.421386Z",
"structure_string": "Na4 Ni4 P4 O16\n1.0\n4.957976 -0.000000 0.000000\n-0.000000 6.137619 0.000000\n0.000000 0.000000 10.117489\nNa Ni P O\n4 4 4 16\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.500000 0.000000 Na\n0.500000 0.000000 0.500000 Na\n0.500000 0.500000 0.500000 Na\n0.511602 0.250000 0.219841 Ni\n0.011601 0.750000 0.280159 Ni\n0.988400 0.250000 0.719841 Ni\n0.488399 0.750000 0.780159 Ni\n0.439958 0.250000 0.892300 P\n0.939958 0.750000 0.607700 P\n0.060043 0.250000 0.392300 P\n0.560043 0.750000 0.107700 P\n0.303934 0.050931 0.820554 O\n0.303934 0.449069 0.820554 O\n0.803935 0.550931 0.679446 O\n0.803935 0.949069 0.679446 O\n0.249338 0.750000 0.613287 O\n0.159855 0.250000 0.537776 O\n0.840146 0.750000 0.462224 O\n0.250663 0.750000 0.113287 O\n0.196066 0.050931 0.320554 O\n0.196066 0.449069 0.320554 O\n0.696067 0.550931 0.179446 O\n0.696067 0.949069 0.179446 O\n0.749338 0.250000 0.886713 O\n0.340146 0.250000 0.037776 O\n0.750663 0.250000 0.386713 O\n0.659855 0.750000 0.962224 O\n",
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{
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{
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"created_at": "2022-09-04T14:38:11.679243Z",
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"structure_string": "Ba4 Na1 Si1\n1.0\n0.000000 5.076017 5.076017\n5.076017 -0.000000 5.076017\n5.076017 5.076017 0.000000\nBa Na Si\n4 1 1\ndirect\n0.118769 0.627077 0.627077 Ba\n0.627077 0.627077 0.627077 Ba\n0.627077 0.118769 0.627077 Ba\n0.627077 0.627077 0.118769 Ba\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Si\n",
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]
}