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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	24-Feb-2020	/SupportingStructures/Benchmark/dlpno_ccpVQZ Benzanaldehyde	Pérez-Soto, Raúl	Orca; 4.0.1.2; RELEASE	Single point	DLPNO-CCSD(T)	cc-pVQZ; AutoAux	-343.58297454; Eh
	24-Feb-2020	/PaperStructures/Solvation/dlpno/vacuum TS2NW	Pérez-Soto, Raúl	Orca; 4.0.1.2; RELEASE	Single point	DLPNO-CCSD(T)	cc-pVTZ; AutoAux	-844.34689893; Eh
	24-Feb-2020	/PaperStructures/Solvation/dlpno/vacuum Benzaldehyde	Pérez-Soto, Raúl	Orca; 4.0.1.2; RELEASE	Single point	DLPNO-CCSD(T)	cc-pVTZ; AutoAux	-343.54771577; Eh
	24-Feb-2020	/SupportingStructures/Benchmark/dlpno_ccpVTZ Water	Pérez-Soto, Raúl	Orca; 4.0.1.2; RELEASE	Single point	DLPNO-CCSD(T)	cc-pVTZ; AutoAux	-76.06414793; Eh
	24-Feb-2020	/SupportingStructures/Benchmark/dlpno_ccpVTZ Imine	Pérez-Soto, Raúl	Orca; 4.0.1.2; RELEASE	Single point	DLPNO-CCSD(T)	cc-pVTZ; AutoAux	-479.90281541; Eh
	24-Feb-2020	/SupportingStructures/Benchmark/dlpno_ccpVDZ TS2N	Pérez-Soto, Raúl	Orca; 4.0.1.2; RELEASE	Single point	DLPNO-CCSD(T)	cc-pVDZ; AutoAux	-768.07569184; Eh
	24-Feb-2020	/PaperStructures/Solvation/dlpno/vacuum TS2WW	Pérez-Soto, Raúl	Orca; 4.0.1.2; RELEASE	Single point	DLPNO-CCSD(T)	cc-pVTZ; AutoAux	-708.01674893; Eh
	24-Feb-2020	/PaperStructures/Solvation/dlpno/vacuum TS2	Pérez-Soto, Raúl	Orca; 4.0.1.2; RELEASE	Single point	DLPNO-CCSD(T)	cc-pVTZ; AutoAux	-555.84336838; Eh
	24-Feb-2020	/PaperStructures/Solvation/dlpno/solution Water	Pérez-Soto, Raúl	Orca; 4.0.1.2; RELEASE	Single point	DLPNO-CCSD(T)	cc-pVTZ; AutoAux	-76.06452542; Eh
	24-Feb-2020	/PaperStructures/Solvation/dlpno/vacuum Water	Pérez-Soto, Raúl	Orca; 4.0.1.2; RELEASE	Single point	DLPNO-CCSD(T)	cc-pVTZ; AutoAux	-76.05656923; Eh

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