public static IAtomContainer DDT()
{
var ddt = new AtomContainer();
var benzeneLeft = Benzene();
benzeneLeft.AddBond(benzeneLeft.Atoms[0], benzeneLeft.AddAtom("Cl"), BondOrder.Single);
var benzeneRight = Benzene();
benzeneRight.AddBond(benzeneRight.Atoms[0], benzeneRight.AddAtom("Cl"), BondOrder.Single);
var carbon00 = ddt.AddAtom("C");
benzeneLeft.Atoms.Add(carbon00);
benzeneLeft.AddBond(benzeneLeft.Atoms[3], carbon00, BondOrder.Single);
benzeneRight.Atoms.Add(carbon00);
benzeneRight.AddBond(benzeneRight.Atoms[3], carbon00, BondOrder.Single);
ddt.AddAtomContainer(benzeneLeft);
ddt.AddAtomContainer(benzeneRight);
var carbon01 = ddt.AddAtom("C");
ddt.AddBond(carbon00, carbon01, BondOrder.Single);
for (var i = 0; i < 3; i++)
{
ddt.AddBond(carbon01, ddt.AddAtom("Cl"), BondOrder.Single);
}
ddt.SetProperty(NCDK.CDKPropertyName.Title, "DDT");
return(ddt);
}