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{
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"structure_string": "Ca1 Fe2 As2\n1.0\n3.972816 0.000000 -0.000000\n0.000000 3.972816 0.000000\n-1.986408 -1.986408 5.247653\nCa Fe As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.250000 0.750000 0.500000 Fe\n0.750000 0.250000 0.500000 Fe\n0.637905 0.637905 0.275808 As\n0.362096 0.362096 0.724191 As\n",
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"structure_string": "Ca1 Fe2 As2\n1.0\n3.972558 -0.000000 -0.000000\n-0.000000 3.972558 -0.000000\n-1.986278 -1.986278 5.249540\nCa Fe As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.750000 0.250000 0.500000 Fe\n0.250000 0.750000 0.500000 Fe\n0.637920 0.637920 0.275840 As\n0.362080 0.362080 0.724160 As\n",
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{
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"structure_string": "Ca2 Fe4 As4\n1.0\n3.972931 -0.000000 -0.000000\n0.000000 3.972931 0.000000\n0.000000 -0.000000 10.494573\nCa Fe As\n2 4 4\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Ca\n0.500000 0.000000 0.250000 Fe\n0.000000 0.500000 0.750000 Fe\n0.000000 0.500000 0.250000 Fe\n0.500000 0.000000 0.750000 Fe\n0.000000 0.000000 0.637898 As\n0.500000 0.500000 0.137898 As\n0.000000 0.000000 0.362102 As\n0.500000 0.500000 0.862102 As\n",
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{
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"structure_string": "Ca2 Fe2 As2 F2\n1.0\n3.877564 -0.000000 -0.000000\n0.000000 3.877564 0.000000\n0.000000 -0.000000 8.293448\nCa Fe As F\n2 2 2 2\ndirect\n0.749999 0.749999 0.658460 Ca\n0.250000 0.250000 0.341541 Ca\n0.250000 0.749999 0.000000 Fe\n0.749999 0.250000 0.000000 Fe\n0.749999 0.749999 0.155312 As\n0.250000 0.250000 0.844689 As\n0.250000 0.749999 0.500000 F\n0.749999 0.250000 0.500000 F\n",
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{
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"created_at": "2022-09-04T14:35:41.881408Z",
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"structure_string": "Ca2 Fe2 As2 F2\n1.0\n-3.877765 0.000000 0.028531\n-0.028676 0.000000 -3.877910\n0.000000 -8.297635 0.000000\nCa Fe As F\n2 2 2 2\ndirect\n0.749999 0.250000 0.158448 Ca\n0.250000 0.750000 0.841551 Ca\n0.750000 0.750000 0.500008 Fe\n0.250000 0.250000 0.499991 Fe\n0.749999 0.250000 0.655230 As\n0.250000 0.750000 0.344769 As\n0.750000 0.750000 -0.000012 F\n0.250000 0.250000 0.000012 F\n",
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"structure_string": "Ca2 Fe2 As2 F2\n1.0\n-2.742638 -2.742965 0.000000\n-2.742638 2.742965 -0.000000\n0.000000 -0.000000 -8.295205\nCa Fe As F\n2 2 2 2\ndirect\n0.250001 0.750000 0.158430 Ca\n0.750000 0.250001 0.841570 Ca\n0.250000 0.250000 0.500000 Fe\n0.750001 0.750001 0.500000 Fe\n0.250001 0.750000 0.655206 As\n0.750000 0.250001 0.344795 As\n0.250000 0.250000 0.000000 F\n0.750001 0.750001 0.000000 F\n",
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"structure_string": "Ca2 Mg2 As2 O8 F2\n1.0\n5.474670 -0.007016 -1.337521\n-1.966809 5.109180 -1.337521\n-0.012334 -0.017940 7.115142\nCa Mg As O F\n2 2 2 8 2\ndirect\n0.167708 0.332292 0.250000 Ca\n0.832293 0.667707 0.750000 Ca\n0.500000 -0.000000 -0.000000 Mg\n0.500000 -0.000000 0.500000 Mg\n0.821166 0.678833 0.250000 As\n0.178834 0.321166 0.750000 As\n0.759716 0.381335 0.073932 O\n0.118664 0.740284 0.426068 O\n0.171143 0.099803 0.881166 O\n0.400197 0.328857 0.618833 O\n0.828857 0.900196 0.118833 O\n0.599803 0.671142 0.381167 O\n0.240284 0.618664 0.926068 O\n0.881336 0.259716 0.573932 O\n0.417973 0.082027 0.250000 F\n0.582027 0.917973 0.750000 F\n",
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