CAS	Chemical Name	SMILES	#Obs_CA_with_S9	#in vitro predicted CA with S9	Reference
1910-42-5	Paraquat dichloride	Cn{+}1(.Cl{-})ccc(-c2ccn{+}(C)(.Cl{-})cc2)cc1	in vitro CA positive	in vitro CA positive	Sofuni, T., Ed. (1998). Data Book of Chromosomal Aberration Test in vitro, Revised Edition. Life-Science Information Center, Tokyo, Japan