{"success":true,"data":{"mat_id":"agm006233095","formula":"CuH44C12N8(ClO5)2","summary":{"formula":"CuH44C12N8(ClO5)2","spg":2,"spg_symbol":"P-1","crystal_system":"triclinic","point_group":"-1","nsites":77,"n_elements":6,"elements":["Cu","H","C","N","Cl","O"]},"energy":{"e_above_hull":0.1669358,"e_form":-0.67233115,"energy_corrected":-424.87396,"energy_total":-417.85106573},"electronic":{"band_gap_ind":0.8662,"band_gap_dir":0.8784,"dos_ef":-0.1785772},"magnetic":{"total_mag":1.007523},"structure":{"a":9.77442715880636,"b":9.251704743216054,"c":9.60019745028728,"alpha":121.4058461442644,"beta":96.1530236133052,"gamma":101.2005978476167,"volume":703.9704914970326,"n_sites":77},"meta":{"prototype_id":"AB2C8D10E12F44_0_spg2","decomposition":" H5NO  H7N2Cl  H6C(NO)2  H2O  Cu  C ","run_timestamp":"2024-11-07 02:16:00"},"composition":{"Cu":1,"H":44,"C":12,"N":8,"Cl":2,"O":10}}}