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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	17-Nov-2021	E067	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-TZVPP/C	-402.37865053; Eh
	17-Nov-2021	E066	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-TZVPP/C	-708.92344562; Eh
	17-Nov-2021	E068	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-TZVPP/C	-422.25839940; Eh
	17-Nov-2021	E070	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-TZVPP/C	-786.33723121; Eh
	17-Nov-2021	C78	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-TZVPP/C	-1214.34658480; Eh
	17-Nov-2021	C79	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-TZVPP/C	-1214.34420584; Eh
	17-Nov-2021	E071	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-TZVPP/C	-594.11896716; Eh
	17-Nov-2021	E072	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-TZVPP/C	-653.29072723; Eh
	17-Nov-2021	C80	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-TZVPP/C	-1175.05227453; Eh
	17-Nov-2021	C82	von Wolff, Niklas	Orca; 4.2.1; RELEASE	Single point	RKS	def2-TZVPP; def2-TZVPP/C	-1291.79293729; Eh

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