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Item hits:

Preview	Issue Date	Title	Author(s)	Program	Calculation type	Method(s)	Basis Set	Energy	Solv.	Vibr.	Orb.
	30-May-2022	Product	Prasad, Supreeth	Gaussian; 16; ES64L-G16RevA.03	Single point Minimum	RB3LYP	DEF2SVP	-595.687909087; Eh
	30-May-2022	AcOH	Prasad, Supreeth	Gaussian; 16; ES64L-G16RevA.03	Single point Minimum	RB3LYP	DEF2SVP	-228.914750822; Eh
	30-May-2022	IM9	Prasad, Supreeth	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	DEF2SVP	-1096.62497790; Eh
	30-May-2022	IM8	Prasad, Supreeth	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	DEF2SVP	-1096.64456396; Eh
	30-May-2022	Arene	Prasad, Supreeth	Gaussian; 16; ES64L-G16RevA.03	Single point Minimum	RB3LYP	DEF2SVP	-479.045285911; Eh
	30-May-2022	IM6	Prasad, Supreeth	Gaussian; 16; ES64L-G16RevA.03	Geometry optimization Minimum	RB3LYP	DEF2SVP	-3711.01836762; Eh
	30-May-2022	IM4	Prasad, Supreeth	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	DEF2SVP	-3711.05661572; Eh
	30-May-2022	IM5	Prasad, Supreeth	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	DEF2SVP	-3711.07011845; Eh
	30-May-2022	IM2	Prasad, Supreeth	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	DEF2SVP	-1207.74037676; Eh
	30-May-2022	IM7	Prasad, Supreeth	Gaussian; 16; ES64L-G16RevA.03	Single point Structure	RB3LYP	DEF2SVP	-1096.62643732; Eh

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