{"success":true,"data":{"mat_id":"agm005652969","formula":"Th3(I2Br)2","summary":{"formula":"Th3(I2Br)2","spg":187,"spg_symbol":"P-6m2","crystal_system":"hexagonal","point_group":"-6m2","nsites":9,"n_elements":3,"elements":["Th","I","Br"]},"energy":{"e_above_hull":0.04325703,"e_form":-1.1513617,"energy_corrected":-42.175655,"energy_total":-42.17565473},"electronic":{"band_gap_ind":0.0676,"band_gap_dir":0.4597,"dos_ef":2.7940102},"magnetic":{"total_mag":-0.000145},"structure":{"a":3.95462986,"b":3.9546290928979655,"c":32.019353890000026,"alpha":89.99999939087797,"beta":89.99999848073067,"gamma":119.99999773967299,"volume":433.6654305981171,"n_sites":9},"meta":{"prototype_id":"A2B3C4_148_spg187","decomposition":" ThI2  ThBr2 ","run_timestamp":"2023-06-26 18:08:51.031448"},"composition":{"Th":3,"I":4,"Br":2}}}