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Title	Author(s)	Program	Method(s)	Basis Set	Energy
ioxynil_CONF1_gas	Pulgar Rubio, Antonio	Gaussian; 16; EM64L-G16RevC.01	RB3LYP; TD-FC	6-311+G(D,P) LANL2DZ 6-311+G(3DF,2P) GEN	-421.4224742; Eh
ioxynil_CONF1_octanol	Pulgar Rubio, Antonio	Gaussian; 16; EM64L-G16RevC.01	RB3LYP; TD-FC	6-311+G(D,P) LANL2DZ 6-311+G(3DF,2P) GEN	-421.4356177; Eh
ioxynil_CONF1_water	Pulgar Rubio, Antonio	Gaussian; 16; EM64L-G16RevC.01	RB3LYP; TD-FC	6-311+G(D,P) LANL2DZ 6-311+G(3DF,2P) GEN	-421.4375306; Eh

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