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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	21-Nov-2022	DMA_C2-C6_3_5_TS2_MN15_def2-QZVPP_SMD_chloroform_DLNPO-CCSDT_SIN	Ahmed, Yusef	Orca; 5.0.3; RELEASE	Single point	DLPNO-CCSD(T)	def2-QZVPP; def2-QZVPP/C	-1754.37946858; Eh
	21-Nov-2022	DMA_C2-C6_3_3_TS_MN15_def2-QZVPP_SMD_chloroform_DLNPO-CCSDT_SING	Ahmed, Yusef	Orca; 5.0.3; RELEASE	Single point	DLPNO-CCSD(T)	def2-QZVPP; def2-QZVPP/C	-1754.34440238; Eh
	21-Nov-2022	OCH3_C4_3_3_product_MN15_def2-SVP	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RMN15	DEF2SVP	-1605.71857374; Eh
	21-Nov-2022	NH2_C2-C5_3_5_product_MN15_def2-SVP	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	RMN15	DEF2SVP	-1601.91788159; Eh
	21-Nov-2022	Parent_3_5_reactant_MN15_def2-SVP	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	DEF2SVP	-1491.41337613; Eh
	21-Nov-2022	OCH3_C2-C5_3_3_TS_MN15_def2-SVP	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization TS	RMN15	DEF2SVP	-1719.96222394; Eh
	21-Nov-2022	NH2_C2-C5_3_5_TS1_MN15_def2-SVP	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RMN15	DEF2SVP	-1601.87029139; Eh
	21-Nov-2022	OCH3_C2_3_3_TS_MN15_def2-SVP	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RMN15	DEF2SVP	-1605.67168316; Eh
	21-Nov-2022	NH2_C2-C5_3_5_TS2_MN15_def2-SVP	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RMN15	DEF2SVP	-1601.87208627; Eh
	21-Nov-2022	DMA_C3_3_3_TS_MN15_def2-SVP	Ahmed, Yusef	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization TS	RMN15	DEF2SVP	-1625.03906837; Eh

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