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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	7-Mar-2023	8-chloro-2-methylquinoline_H2O_0_ACN_1_w_Ehigh	Haack, Alexander	Orca; 5.0.2; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-1029.85113613; Eh
	7-Mar-2023	8-chloro-2-methylquinoline_H2O_1_ACN_1_a_Ehigh	Haack, Alexander	Orca; 5.0.2; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-1105.92944655; Eh
	7-Mar-2023	8-chloro-2-methylquinoline_H2O_1_ACN_0_z_Ehigh	Haack, Alexander	Orca; 5.0.2; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-973.92970838; Eh
	7-Mar-2023	8-chloro-2-methylquinoline_H2O_1_ACN_0_a_Ehigh	Haack, Alexander	Orca; 5.0.2; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-973.93327960; Eh
	7-Mar-2023	8-chloro-2-methylquinoline_H2O_0_ACN_2_a_Ehigh	Haack, Alexander	Orca; 5.0.2; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-1161.84667008; Eh
	7-Mar-2023	8-chloro-2-methylquinoline_H2O_0_ACN_1_a_Ehigh	Haack, Alexander	Orca; 5.0.2; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-1029.85491627; Eh
	7-Mar-2023	8-chloro-2-methylquinoline_H2O_1_ACN_0_w_Ehigh	Haack, Alexander	Orca; 5.0.2; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-973.93054968; Eh
	7-Mar-2023	8-chloro-2-methylquinoline_H2O_0_ACN_1_x_Ehigh	Haack, Alexander	Orca; 5.0.2; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-1029.85056711; Eh
	7-Mar-2023	8-chloro-2-methylquinoline_H2O_0_ACN_0_a_Ehigh	Haack, Alexander	Orca; 5.0.2; RELEASE	Single point	DLPNO-CCSD(T)	def2-TZVPP; def2-TZVPP/C	-897.85645218; Eh
	3-May-2023	B2-TS_sp	Mulks, Florian	Orca; 5.0.3; RELEASE	Single point	DLPNO-CCSD(T)	aug-cc-pVTZ; aug-cc-pVTZ/C	-1756.00429870; Eh

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