{"success":true,"data":{"mat_id":"agm080426746","formula":"Al3Ir(IBr)6","summary":{"formula":"Al3Ir(IBr)6","spg":1,"spg_symbol":"P1","crystal_system":"triclinic","point_group":"1","nsites":16,"n_elements":4,"elements":["Al","Ir","I","Br"]},"energy":{"e_above_hull":0.07799272,"e_form":-0.66133153,"energy_corrected":-50.016953,"energy_total":-50.01695393},"electronic":{"band_gap_ind":1.9438,"band_gap_dir":1.9472,"dos_ef":0},"magnetic":{"total_mag":0},"structure":{"a":9.829107366422361,"b":9.727491206522417,"c":9.798607383076636,"alpha":87.82759013604769,"beta":85.72995338692,"gamma":94.25548059187706,"volume":930.8046831926956,"n_sites":16},"meta":{"prototype_id":"AB3C6D6_42_spg1","decomposition":" IrI3  AlBr3  AlI3 ","run_timestamp":"2025-02-22 17:24:18"},"composition":{"Al":3,"Ir":1,"I":6,"Br":6}}}