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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-63-t3ob/3x-tbubrettphos-63-t3ob-orcasp 3x-tbubrettphos-63-t3ob-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2537.08147697; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-65-t4ob/3x-tbubrettphos-65-t4ob-orcasp 3x-tbubrettphos-65-t4ob-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2537.08368650; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-60-ts-t2-t3ob/3x-tbubrettphos-60-ts-t2-t3ob-opt 3x-tbubrettphos-60-ts-t2-t3ob-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2692.50936903; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-61-t3ob-2h2o/3x-tbubrettphos-61-t3ob-2h2o-opt 3x-tbubrettphos-61-t3ob-2h2o-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2692.52861969; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-59-t2-2h2o/3x-tbubrettphos-59-t2-2h2o-opt 3x-tbubrettphos-59-t2-2h2o-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2692.53426671; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-32-ts-xb-t3/3x-tbubrettphos-32-ts-xb-t3-opt 3x-tbubrettphos-32-ts-xb-t3-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-2364.15196629; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-31-xb/3x-tbubrettphos-31-xb-opt 3x-tbubrettphos-31-xb-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2287.87817997; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-60-ts-t2-t3ob/3x-tbubrettphos-60-ts-t2-t3ob-orcasp 3x-tbubrettphos-60-ts-t2-t3ob-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2689.54811863; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-59-t2-2h2o/3x-tbubrettphos-59-t2-2h2o-orcasp 3x-tbubrettphos-59-t2-2h2o-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2689.59473381; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-32-ts-xb-t3/3x-tbubrettphos-32-ts-xb-t3-orcasp 3x-tbubrettphos-32-ts-xb-t3-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2361.38713438; Eh

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