{"success":true,"data":{"mat_id":"agm005691064","formula":"Th(ICl3)2","summary":{"formula":"Th(ICl3)2","spg":12,"spg_symbol":"C2\/m","crystal_system":"monoclinic","point_group":"2\/m","nsites":9,"n_elements":3,"elements":["Th","I","Cl"]},"energy":{"e_above_hull":0.077569075,"e_form":-1.5811377,"energy_corrected":-32.275978,"energy_total":-32.2759778},"electronic":{"band_gap_ind":1.7546,"band_gap_dir":1.805,"dos_ef":0},"magnetic":{"total_mag":0},"structure":{"a":7.9639358365035,"b":7.074209118548761,"c":8.00206508551557,"alpha":63.766916943488134,"beta":94.93404693419869,"gamma":101.22020262035221,"volume":396.66197197607954,"n_sites":9},"meta":{"prototype_id":"AB2C6_2066_spg12","decomposition":" ICl  ThCl4 ","run_timestamp":"2023-07-06 19:31:53.341723"},"composition":{"Th":1,"I":2,"Cl":6}}}