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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	9-Nov-2018	/noDisp/complexes sin-shoso3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-714.827587; Eh
	9-Nov-2018	/noDisp/complexes sin-sk	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-426.5340303; Eh
	9-Nov-2018	/noDisp/complexes sin-piridinacunh33	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	UB3LYP	6-31+g; sdd*	-614.8454347; Eh
	9-Nov-2018	/noDisp/complexes sin-piridinaconh35	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-676.0318742; Eh
	9-Nov-2018	/noDisp/complexes sin-piridinaauph3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-727.0573477; Eh
	9-Nov-2018	/noDisp/complexes sin-piridinaalcl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g*	-1871.5770137; Eh
	9-Nov-2018	/noDisp/complexes sin-ph3ZrCl5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-2691.6523462; Eh
	9-Nov-2018	/noDisp/complexes sin-ph3wco5	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-977.0624651; Eh
	9-Nov-2018	/noDisp/complexes sin-ph3ticl3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-1782.0026784; Eh
	9-Nov-2018	/noDisp/complexes sin-ph3znch3	Besora, Maria	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RB3LYP	6-31+g; sdd*	-609.9591407; Eh

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