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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-00-lpdoh2/3x-tbubrettphos-00-lpdoh2-orcasp 3x-tbubrettphos-00-lpdoh2-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-3953.50226925; Eh
	26-Jan-2025	/3v-tbudavephos/3v-tbudavephos-11-c4/3v-tbudavephos-11-c4-orcasp 3v-tbudavephos-11-c4-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1913.88876961; Eh
	26-Jan-2025	/3z-adjohnphos/3z-adjohnphos-21-t4/3z-adjohnphos-21-t4-orcasp 3z-adjohnphos-21-t4-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2243.45716862; Eh
	26-Jan-2025	/3g-ptbu2cy/3g-ptbu2cy-21-t4/3g-ptbu2cy-21-t4-orcasp 3g-ptbu2cy-21-t4-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1553.61657593; Eh
	26-Jan-2025	/9c-etjohnphos/9c-etjohnphos-17-ts-t2-t3/9c-etjohnphos-17-ts-t2-t3-opt 9c-etjohnphos-17-ts-t2-t3-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RPBEPBE	DEF2SVP DEF2SVP/W06	-1877.55463165; Eh
	26-Jan-2025	/9a-cbujohnphos/9a-cbujohnphos-43-t3-lig/9a-cbujohnphos-43-t3-lig-opt 9a-cbujohnphos-43-t3-lig-opt	Ser, Cher Tian	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RPBEPBE	DEF2SVP DEF2SVP/W06	-2895.52892300; Eh
	5-May-2025	/3m-cyjohnphos/3m-cyjohnphos-6cne17-et2-h2o/3m-cyjohnphos-6cne17-et2-h2o-orcasp 3m_cyjohnphos_6cne17_et2_h2o	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2512.56249491; Eh
	26-Jan-2025	/3t-tbujohnphos/3t-tbujohnphos-23-ts-c5-c6/3t-tbujohnphos-23-ts-c5-c6-orcasp 3t-tbujohnphos-23-ts-c5-c6-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2032.25555993; Eh
	26-Jan-2025	/3x-tbubrettphos/3x-tbubrettphos-16-t2-h2o/3x-tbubrettphos-16-t2-h2o-orcasp 3x-tbubrettphos-16-t2-h2o-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-2613.32733138; Eh
	26-Jan-2025	/3h-ptbu3/3h-ptbu3-97-ts-hc4-lpd0/3h-ptbu3-97-ts-hc4-lpd0-orcasp 3h-ptbu3-97-ts-hc4-lpd0-orcasp	Ser, Cher Tian	Orca; 5.0.3; RELEASE	Single point	-	def2-QZVPP; def2-QZVPP/C	-1708.57366185; Eh

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