{"success":true,"data":{"mat_id":"agm017246172","formula":"Tl2Cd(BrF)2","summary":{"formula":"Tl2Cd(BrF)2","spg":12,"spg_symbol":"C2\/m","crystal_system":"monoclinic","point_group":"2\/m","nsites":7,"n_elements":4,"elements":["Tl","Cd","Br","F"]},"energy":{"e_above_hull":0,"e_form":-1.5653956,"energy_corrected":-22.80073,"energy_total":-22.80072978},"electronic":{"band_gap_ind":3.0665,"band_gap_dir":3.1053,"dos_ef":0},"magnetic":{"total_mag":0},"structure":{"a":7.7157851905079475,"b":7.715785184880546,"c":8.061624893451155,"alpha":52.961523814582605,"beta":127.03847616019316,"gamma":149.01643157844208,"volume":192.8547004854558,"n_sites":7},"meta":{"prototype_id":"AB2C2D2_13_spg12","decomposition":" Tl2Cd(BrF)2 ","run_timestamp":"2025-01-20 18:33:19"},"composition":{"Tl":2,"Cd":1,"Br":2,"F":2}}}