{"success":true,"data":{"mat_id":"agm005685108","formula":"Th(BrCl3)2","summary":{"formula":"Th(BrCl3)2","spg":12,"spg_symbol":"C2\/m","crystal_system":"monoclinic","point_group":"2\/m","nsites":9,"n_elements":3,"elements":["Th","Br","Cl"]},"energy":{"e_above_hull":0.07024058,"e_form":-1.5383146,"energy_corrected":-32.13607,"energy_total":-32.13606836},"electronic":{"band_gap_ind":2.2096,"band_gap_dir":2.2697,"dos_ef":0},"magnetic":{"total_mag":0},"structure":{"a":7.566285983539173,"b":7.192233291452318,"c":7.583786394147276,"alpha":61.69371490398121,"beta":93.91272867907747,"gamma":98.27378305660946,"volume":359.56814258006773,"n_sites":9},"meta":{"prototype_id":"AB2C6_2066_spg12","decomposition":" BrCl  ThCl4 ","run_timestamp":"2023-07-06 18:11:59.015311"},"composition":{"Th":1,"Br":2,"Cl":6}}}