{"success":true,"data":{"mat_id":"agm005659463","formula":"Ir(Cl3F)2","summary":{"formula":"Ir(Cl3F)2","spg":14,"spg_symbol":"P2_1\/c","crystal_system":"monoclinic","point_group":"2\/m","nsites":18,"n_elements":3,"elements":["Ir","Cl","F"]},"energy":{"e_above_hull":0,"e_form":-0.9928172,"energy_corrected":-56.321117,"energy_total":-56.32111579},"electronic":{"band_gap_ind":0.0196,"band_gap_dir":0.0552,"dos_ef":9.449765},"magnetic":{"total_mag":2.0861027},"structure":{"a":7.33977555,"b":7.120463797066404,"c":9.926992276740133,"alpha":115.88240142266544,"beta":90,"gamma":90,"volume":466.76959354136704,"n_sites":18},"meta":{"prototype_id":"AB2C6_2031_spg14","decomposition":" Ir(Cl3F)2 ","run_timestamp":"2023-07-14 14:49:58.750130"},"composition":{"Ir":2,"Cl":12,"F":4}}}