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"structure_string": "Ca2 Fe3 O8\n1.0\n4.704397 -0.015391 -1.451760\n-0.847202 5.046059 -2.798721\n-0.019032 0.059975 6.190390\nCa Fe O\n2 3 8\ndirect\n0.669647 0.724541 0.449083 Ca\n0.330354 0.275460 0.550918 Ca\n0.500000 0.000000 -0.000000 Fe\n0.000002 0.743653 0.000003 Fe\n-0.000002 0.256347 0.999997 Fe\n0.036170 0.397797 0.795588 O\n0.963831 0.602204 0.204413 O\n0.100424 0.903356 0.806708 O\n0.899577 0.096645 0.193293 O\n0.389713 0.320846 0.199201 O\n0.389718 0.878359 0.199206 O\n0.610283 0.121641 0.800794 O\n0.610288 0.679154 0.800800 O\n",
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{
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"structure_string": "Ca2 Fe2 Si4 O12\n1.0\n5.114136 -0.137438 1.070761\n1.258324 6.546833 0.619812\n-0.183744 0.182021 6.690417\nCa Fe Si O\n2 2 4 12\ndirect\n0.750001 0.303227 0.696772 Ca\n0.250000 0.696772 0.303228 Ca\n0.750000 0.918229 0.081771 Fe\n0.250001 0.081771 0.918230 Fe\n0.268240 0.192788 0.385828 Si\n0.768240 0.385828 0.192788 Si\n0.731761 0.807211 0.614172 Si\n0.231761 0.614171 0.807212 Si\n-0.014338 0.624947 0.672269 O\n0.014339 0.375052 0.327732 O\n0.828933 0.886565 0.382224 O\n0.671067 0.617775 0.113434 O\n0.846388 0.217208 0.027503 O\n0.328934 0.382224 0.886566 O\n0.514339 0.327731 0.375052 O\n0.153613 0.782791 0.972497 O\n0.346388 0.027503 0.217208 O\n0.653613 0.972496 0.782792 O\n0.171068 0.113434 0.617776 O\n0.485662 0.672268 0.624948 O\n",
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"structure_string": "Ca2 Fe2 O4\n1.0\n5.414901 0.000000 0.000000\n0.000000 5.414901 0.000000\n0.000000 0.000000 3.185086\nCa Fe O\n2 2 4\ndirect\n0.500000 0.000000 0.500009 Ca\n0.000000 0.500000 0.499992 Ca\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.000000 Fe\n0.750032 0.749968 0.000044 O\n0.250032 0.750032 -0.000044 O\n0.749968 0.249968 -0.000044 O\n0.249968 0.250032 0.000044 O\n",
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"created_at": "2022-09-04T14:36:11.082161Z",
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"structure_string": "Ca2 Fe2 O4\n1.0\n0.000000 -0.000000 3.185337\n5.415560 -0.000000 -0.000000\n-0.000000 5.415560 0.000000\nCa Fe O\n2 2 4\ndirect\n0.500007 0.500000 0.000000 Ca\n0.499994 0.000000 0.500000 Ca\n0.000000 0.500000 0.500000 Fe\n0.000000 0.000000 0.000000 Fe\n-0.000052 0.749969 0.249969 O\n0.000052 0.750031 0.749969 O\n-0.000052 0.250031 0.750031 O\n0.000052 0.249969 0.250031 O\n",
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{
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"created_at": "2022-09-04T14:38:09.266383Z",
"updated_at": "2022-09-04T14:38:09.266418Z",
"structure_string": "Ca2 Fe2 Ge4 O12\n1.0\n5.313491 -0.134119 1.044759\n1.169985 6.678923 0.867880\n-0.167074 0.166077 6.831880\nCa Fe Ge O\n2 2 4 12\ndirect\n0.750000 0.309846 0.690154 Ca\n0.250000 0.690154 0.309846 Ca\n0.749999 0.918963 0.081037 Fe\n0.250000 0.081037 0.918963 Fe\n0.770112 0.389483 0.182017 Ge\n0.729887 0.817983 0.610516 Ge\n0.229888 0.610516 0.817983 Ge\n0.270112 0.182017 0.389484 Ge\n0.637729 0.985488 0.790910 O\n0.862270 0.209090 0.014512 O\n0.646022 0.635849 0.102679 O\n0.853977 0.897320 0.364151 O\n0.353978 0.364151 0.897321 O\n0.974801 0.606303 0.675291 O\n0.025198 0.393697 0.324709 O\n0.474801 0.675291 0.606303 O\n0.137730 0.790910 0.985488 O\n0.525198 0.324709 0.393697 O\n0.146023 0.102679 0.635849 O\n0.362270 0.014512 0.209090 O\n",
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"structure_string": "Ca2 Fe2 F8\n1.0\n5.411787 0.000582 -0.001953\n-0.000600 5.363929 -0.000651\n-2.703375 -2.679969 5.344341\nCa Fe F\n2 2 8\ndirect\n0.251266 0.248645 0.502099 Ca\n0.751198 0.748642 0.502095 Ca\n0.550486 0.059047 0.002150 Fe\n0.952042 0.559007 0.002109 Fe\n0.451271 0.312283 0.268826 F\n0.184551 0.044986 0.735241 F\n0.582900 0.672531 0.760171 F\n0.050945 0.544937 0.735135 F\n0.824917 0.914737 0.244216 F\n0.317904 0.812244 0.268739 F\n0.919668 0.414712 0.244161 F\n0.677574 0.172515 0.760126 F\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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