{"success":true,"data":{"mat_id":"agm047672948","formula":"KAu3(BrF3)2","summary":{"formula":"KAu3(BrF3)2","spg":2,"spg_symbol":"P-1","crystal_system":"triclinic","point_group":"-1","nsites":12,"n_elements":4,"elements":["K","Au","Br","F"]},"energy":{"e_above_hull":0.026730578,"e_form":-1.3689185,"energy_corrected":-39.230347,"energy_total":-39.2303483},"electronic":{"band_gap_ind":0.7545,"band_gap_dir":0.8963,"dos_ef":-0.3156935},"magnetic":{"total_mag":0},"structure":{"a":5.6213585152117105,"b":7.164379591343514,"c":8.616159780087742,"alpha":107.62193876332803,"beta":111.56501411760132,"gamma":93.62457350290693,"volume":301.5512912149697,"n_sites":12},"meta":{"prototype_id":"AB2C3D6_238_spg12","decomposition":" AuBr  AuBrF2  KAuF4 ","run_timestamp":"2025-02-23 20:10:13"},"composition":{"K":1,"Au":3,"Br":2,"F":6}}}