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a) Plot of the ELF function for the TYR/O2 optimized complex. The topology involves two sets of three-center Cu-O-Cu bonds above and below the Cu2O2 central metallic; b) Plot of the ELF function for the TYR/O2/dimethylbenzoate complex. The topology involving two three-center Cu-O-Cu bonds above and below the Cu2O2 central metallic core is conserved despite an apparent “zig-zag” configuration.
