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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	16-Jul-2018	/Ru-iPr-Cl-First_Reaction-BSSE 1	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RwB97XD	sdd; 6-311++g**	-2063.20549335; Eh
	16-Jul-2018	/Ru-iPr-OAc-First_Reaction-BSSE 3	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RwB97XD	sdd; 6-311++g**	-1831.46329430; Eh
	16-Jul-2018	/Ru-iPr-OAc-First_Reaction-BSSE TS-I3-4	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RwB97XD	sdd; 6-311++g**	-2139.81426225; Eh
	16-Jul-2018	/Ru-iPr-OAc-First_Reaction-BSSE TS-3-I3	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RwB97XD	sdd; 6-311++g**	-2139.81446564; Eh
	16-Jul-2018	/Ru-iPr-OAc-First_Reaction-BSSE I3	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RwB97XD	sdd; 6-311++g**	-2139.82086917; Eh
	16-Jul-2018	/Ru-iPr-OAc-Second_Reaction-BSSE 5	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RwB97XD	sdd; 6-311++g**	-2138.64883122; Eh
	16-Jul-2018	/Ru-iPr-OAc-Second_Reaction-BSSE I4	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RwB97XD	sdd; 6-311++g**	-2448.24652540; Eh
	16-Jul-2018	/Ru-iPr-OAc-First_Reaction-BSSE 4	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RwB97XD	sdd; 6-311++g**	-2139.88688426; Eh
	16-Jul-2018	/Ru-iPr-OAc-Second_Reaction-BSSE 4	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RwB97XD	sdd; 6-311++g**	-2139.88688426; Eh
	16-Jul-2018	/Ru-iPr-OAc-Second_Reaction-BSSE I7	Fondevila, Adiran J. De Aguirre	Gaussian; 09; EM64L-G09RevD.01	Single point Structure	RwB97XD	sdd; 6-311++g**	-2448.24329919; Eh

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