%nprocshared=20
%mem=90GB
%oldchk=cisIrH2DCMIMesPPh3_01_optbbt
%chk=cisIrH2DCMIMesPPh3_01_optbbt_qzsolv
#p gfinput gfprint scf(maxcyc=500,XQC) nosymm m06l/def2qzvp integral(superfine) guess=read geom=checkpoint sp scrf(smd,solvent=dichloromethane)

cis-[Ir(H)2(DCM)(IMes)(PPh3)]

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