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Item hits:

Preview	Title	Author(s)	Program	Method(s)	Basis Set	Energy	Solv.	Vibr.
	bromoxynil_CONF1_gas	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	-	def2-TZVPP	-5546.96998322; Eh
	bromoxynil_CONF1_octanol	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	-	def2-TZVPP	-5546.98309792; Eh
	bromoxynil_CONF1_water	Pulgar Rubio, Antonio	Orca; 5.0.2; RELEASE	-	def2-TZVPP	-5546.97714470; Eh
	bromoxynil_CONF1_gas	Pulgar Rubio, Antonio	Gaussian; 16; EM64L-G16RevC.01	RB3LYP; TD-FC	6-311+G(D,P) 6-311+G(3DF,2P)	-5546.954046; Eh
	bromoxynil_CONF1_octanol	Pulgar Rubio, Antonio	Gaussian; 16; EM64L-G16RevC.01	RB3LYP; TD-FC	6-311+G(D,P) 6-311+G(3DF,2P)	-5546.9670156; Eh
	bromoxynil_CONF1_water	Pulgar Rubio, Antonio	Gaussian; 16; EM64L-G16RevC.01	RB3LYP; TD-FC	6-311+G(D,P) 6-311+G(3DF,2P)	-5546.9617484; Eh

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