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ZHANG Jing ping a **; YANG Guang hui b; WANG Rong shun a and WANG Li xiang c (Department of Chemistry; Northeast Normal University a; Changchun 130024; P.R. China; Institute of Theoretical Chemistry b; Jilin University; Chan;
Semiempirical; AM1; CI; calculations; High; spin; molecules; Two; atoms; spin; center;
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