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{
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{
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"structure_string": "Li4 Ca2\n1.0\n5.296153 0.000000 3.057735\n1.765384 4.993260 3.057735\n0.000000 0.000000 6.115470\nLi Ca\n4 2\ndirect\n0.500000 -0.000000 0.500000 Li\n-0.000000 0.500000 0.500000 Li\n0.499999 0.500000 0.500000 Li\n0.499999 0.500000 -0.000000 Li\n0.125000 0.125000 0.125000 Ca\n0.874999 0.875000 0.874999 Ca\n",
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{
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"updated_at": "2022-09-04T14:38:32.218056Z",
"structure_string": "Ti12 Al8 Ni4 N4\n1.0\n6.974068 -0.000000 4.026480\n2.324689 6.575215 4.026480\n0.000000 0.000000 8.052959\nTi Al Ni N\n12 8 4 4\ndirect\n0.809096 0.440904 0.440905 Ti\n0.559096 0.559095 0.190905 Ti\n0.190905 0.190905 0.559095 Ti\n0.559096 0.190905 0.190905 Ti\n0.559096 0.190905 0.559095 Ti\n0.190905 0.559095 0.190905 Ti\n0.440905 0.809095 0.440905 Ti\n0.440905 0.440904 0.809095 Ti\n0.809096 0.809095 0.440905 Ti\n0.809096 0.440904 0.809095 Ti\n0.190905 0.559095 0.559096 Ti\n0.440905 0.809095 0.809096 Ti\n0.791946 0.791945 0.791946 Al\n0.208054 0.208054 0.875839 Al\n0.208054 0.875838 0.208054 Al\n0.875839 0.208054 0.208054 Al\n0.791946 0.791945 0.124161 Al\n0.124162 0.791945 0.791946 Al\n0.208054 0.208054 0.208054 Al\n0.791946 0.124161 0.791946 Al\n0.500000 0.000000 -0.000000 Ni\n0.000000 0.000000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.500000 0.500000 0.500000 N\n0.500000 0.500000 0.000000 N\n0.000000 0.500000 0.500000 N\n0.500000 0.000000 0.500000 N\n",
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{
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"updated_at": "2022-09-04T14:38:32.311084Z",
"structure_string": "Mn24 C4\n1.0\n6.371872 -0.000000 3.678802\n2.123957 6.007459 3.678802\n-0.000000 -0.000000 7.357604\nMn C\n24 4\ndirect\n0.625000 0.625000 0.124999 Mn\n0.801241 0.198759 0.198759 Mn\n0.198759 0.801241 0.198759 Mn\n0.801241 0.801241 0.198759 Mn\n0.198759 0.801241 0.801240 Mn\n0.801241 0.198759 0.801240 Mn\n0.198759 0.198759 0.801240 Mn\n0.448759 0.051241 0.051241 Mn\n0.051241 0.448759 0.051241 Mn\n0.448759 0.448759 0.051240 Mn\n0.051241 0.448759 0.448759 Mn\n0.051241 0.051241 0.448759 Mn\n0.448759 0.051241 0.448759 Mn\n0.494089 0.835303 0.835302 Mn\n0.835303 0.494089 0.835302 Mn\n0.835303 0.835303 0.494089 Mn\n0.414697 0.414697 0.414696 Mn\n0.755910 0.414697 0.414696 Mn\n0.414697 0.755911 0.414696 Mn\n0.414697 0.414697 0.755910 Mn\n0.625000 0.625000 0.624999 Mn\n0.125000 0.625000 0.624999 Mn\n0.625000 0.125000 0.624999 Mn\n0.835303 0.835303 0.835302 Mn\n0.625000 0.125000 0.125000 C\n0.125000 0.125000 0.625000 C\n0.125000 0.625000 0.125000 C\n0.125000 0.125000 0.125000 C\n",
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{
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"created_at": "2022-09-04T14:38:32.335985Z",
"updated_at": "2022-09-04T14:38:32.336004Z",
"structure_string": "Pu2 Mn4\n1.0\n4.205170 -0.000000 2.427856\n1.401723 3.964672 2.427856\n0.000000 0.000000 4.855711\nPu Mn\n2 4\ndirect\n0.875000 0.875000 0.875002 Pu\n0.125000 0.125000 0.125000 Pu\n0.500000 0.500000 0.500001 Mn\n0.500000 0.500000 0.000001 Mn\n-0.000000 0.500000 0.500001 Mn\n0.500000 0.000000 0.500000 Mn\n",
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{
"id": "jvasp-55508",
"created_at": "2022-09-04T14:38:32.876623Z",
"updated_at": "2022-09-04T14:38:32.876648Z",
"structure_string": "In4 Si4 O14\n1.0\n5.833274 0.000000 3.367843\n1.944424 5.499664 3.367843\n0.000000 0.000000 6.735685\nIn Si O\n4 4 14\ndirect\n0.000000 0.000000 0.000000 In\n0.500000 -0.000000 -0.000000 In\n-0.000000 0.500000 0.000000 In\n0.000000 0.000000 0.500000 In\n0.499999 0.500000 0.500000 Si\n0.499999 0.500000 0.000000 Si\n-0.000000 0.500000 0.500000 Si\n0.500000 -0.000000 0.500000 Si\n0.571016 0.178983 0.178983 O\n0.178983 0.178983 0.571017 O\n0.571016 0.571016 0.178983 O\n0.428983 0.821016 0.821017 O\n0.125000 0.125000 0.125000 O\n0.571016 0.178983 0.571017 O\n0.178983 0.571016 0.178983 O\n0.428983 0.821016 0.428984 O\n0.428983 0.428983 0.821017 O\n0.821016 0.821016 0.428984 O\n0.821016 0.428983 0.821017 O\n0.178983 0.571016 0.571017 O\n0.874999 0.874999 0.875001 O\n0.821016 0.428983 0.428984 O\n",
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{
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"structure_string": "U2 Co4\n1.0\n4.236751 -0.000000 2.446089\n1.412250 3.994447 2.446089\n-0.000000 -0.000000 4.892179\nU Co\n2 4\ndirect\n0.875000 0.875001 0.875000 U\n0.125000 0.125000 0.125000 U\n0.500000 0.500000 0.500000 Co\n0.500000 0.500000 0.000000 Co\n-0.000000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 Co\n",
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{
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"structure_string": "Sc4 Zn2 S8\n1.0\n-5.255499 -5.255499 0.000000\n-5.255499 -0.000000 -5.255499\n0.000000 -5.255499 -5.255499\nSc Zn S\n4 2 8\ndirect\n0.000000 0.000000 0.500000 Sc\n0.000000 0.500000 -0.000000 Sc\n0.500000 0.000000 0.000000 Sc\n0.000000 0.000000 0.000000 Sc\n0.375000 0.375000 0.375000 Zn\n0.625000 0.625000 0.625000 Zn\n0.245022 0.245022 0.764934 S\n0.245022 0.764934 0.245022 S\n0.764934 0.245022 0.245022 S\n0.245022 0.245022 0.245022 S\n0.754978 0.754978 0.235066 S\n0.754978 0.235066 0.754978 S\n0.235066 0.754978 0.754978 S\n0.754978 0.754978 0.754978 S\n",
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{
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{
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"structure_string": "Al4 Sb4 O14\n1.0\n6.085190 0.000000 3.513286\n2.028397 5.737171 3.513286\n0.000000 0.000000 7.026571\nAl Sb O\n4 4 14\ndirect\n0.500000 -0.000000 0.500000 Al\n0.000000 0.500000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n0.000000 0.500000 0.000000 Sb\n0.500000 -0.000000 0.000000 Sb\n-0.000000 -0.000000 0.500000 Sb\n0.000000 0.000000 0.000000 Sb\n0.632296 0.117704 0.117704 O\n0.117704 0.117704 0.632296 O\n0.632297 0.632296 0.117704 O\n0.882297 0.367704 0.367704 O\n0.367704 0.882296 0.367704 O\n0.367704 0.367704 0.882297 O\n0.367704 0.882296 0.882297 O\n0.882297 0.367704 0.882297 O\n0.117704 0.632296 0.632297 O\n0.632296 0.117704 0.632297 O\n0.375000 0.375000 0.375000 O\n0.625000 0.625000 0.625001 O\n0.882297 0.882296 0.367704 O\n0.117704 0.632296 0.117704 O\n",
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}