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. Author manuscript; available in PMC: 2013 Aug 9.
Published in final edited form as: J Phys Chem B. 2012 Jul 27;116(31):9409–9416. doi: 10.1021/jp3059068

Figure 1.

Figure 1

B3LYP/6-31++G(d) calculated Mulliken spin density distribution in sugar radicals (dG(C1′•) – dG(C5′•)) and in 5′,8-cyclo-2′-deoxyguanosin-7-yl radical in their two diastereoisomeric forms. Spin densities were calculated with 0.002 electron/bohr3.