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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	6-Mar-2026	aldol_neutral_second_TS68	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.265518380364; Eh	-		-
	6-Mar-2026	aldol_neutral_second_TS69	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.264700033695; Eh	-		-
	12-May-2026	/SN_TS/8-OTf Nidppf_SN_8OTf_B_sp	Ronson, Thomas; Rice, Scott; Nelson, David; Greaves, Megan; McVeigh, Nicholas; Munday, Rachel; Sproules, Stephen	Orca; 6.1.0; RELEASE	Single point	DFT	ma-def2-qzvp	-6041.64297503652142; Eh
	12-May-2026	/SN_TS/8-OTf Nidppf_SN_8OTf_C_sp	Ronson, Thomas; Rice, Scott; Nelson, David; Greaves, Megan; McVeigh, Nicholas; Munday, Rachel; Sproules, Stephen	Orca; 6.1.0; RELEASE	Single point	DFT	ma-def2-qzvp	-6041.63793957263624; Eh
	12-May-2026	/SN_TS/8-OTf Nidppf_SN_8OTf_C_opt	Ronson, Thomas; Rice, Scott; Nelson, David; Greaves, Megan; McVeigh, Nicholas; Munday, Rachel; Sproules, Stephen	Orca; 6.0.1; RELEASE	Geometry optimization TS	DFT	-	-6040.98829542302337; Eh
	6-Mar-2026	aldol_neutral_second_TS150	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.264904266342; Eh	-		-
	6-Mar-2026	aldol_neutral_second_TS151	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.263659955380; Eh	-		-
	6-Mar-2026	aldol_neutral_second_TS143	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.264189243229; Eh	-		-
	6-Mar-2026	aldol_neutral_second_TS146	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.265460354820; Eh	-		-
	6-Mar-2026	aldol_neutral_second_TS147	Matsutani, Satoshi	GRRM; 23	Saddle	wB97XD	def2svpp	-739.263156961729; Eh	-		-

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