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Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	2-Mar-2023	/substituent_effect TS3C4_CF3(S)	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UPBE1PBE	DEF2SVPP	-6461.5463435; Eh
	2-Mar-2023	/substituent_effect TS3C4_diOMe(S)	Guo, Wentao	Gaussian; 16; ES64L-G16RevC.01	Geometry optimization Minimum	UPBE1PBE	DEF2SVPP	-6353.6970191; Eh
	5-Oct-2022	/template-3/ts1/c7 ts1c7_BFONIN	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	GEN	-3058.01281051; Eh
	5-Oct-2022	/template-3/ts1/c4 60_FFONIA	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	GEN	-3058.01693539; Eh
	5-Oct-2022	/template-3/ts1/c4 16_FFIAIA	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	DEF2SVP GEN	-3058.02153712; Eh
	5-Oct-2022	/template-3/ts1/c4 4_1	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	DEF2SVP GEN	-3058.01682625; Eh
	5-Oct-2022	/template-3/ts1/c4 12_FFONIA	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	GEN	-3058.01696250; Eh
	5-Oct-2022	/template-3/ts1/c4 66_FFIAIA	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	DEF2SVP GEN	-3058.02336799; Eh
	5-Oct-2022	/template-3/ts1/c4 1_FFIAIA	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	DEF2SVP GEN	-3058.02137764; Eh
	5-Oct-2022	/template-3/ts1/c4 61_FFIAIA	Fernandez, Gilberto	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RMN15	GEN	-3058.02155313; Eh

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