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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	11-Sep-2020	/Gaussian TS5A	von Wolff, Niklas	Gaussian; 16; ES64L-G16RevB.01	Single point Structure	RM06L	DEF2TZVP/W06	-
	11-Sep-2020	/Orca 5	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1399.39397762; Eh
	11-Sep-2020	/Orca 8	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1480.64257886; Eh
	11-Sep-2020	/Orca Glycolic_acid	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-304.35113715; Eh
	11-Sep-2020	/Orca H2	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1.16103983; Eh
	11-Sep-2020	/Orca TS1Abpy	von Wolff, Niklas	Gaussian; 16; ES64L-G16RevC.01	Single point Structure	RM06L	DEF2TZVP/W06	-
	11-Sep-2020	/Orca TS1CEXP	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-2016.97741780; Eh
	11-Sep-2020	/Orca TS3Abpy	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1704.93908991; Eh
	11-Sep-2020	/Orca TS3B	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1709.71517282; Eh
	11-Sep-2020	/Orca TS3C	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-tzvpp/c	-1709.71959636; Eh

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