@Test
public void testCyclohexaneWithHydrogens() {
IAtomContainer cyclohexane = MoleculeFactory.makeCyclohexane();
for (int i = 0; i < 6; i++) {
addHydrogens(cyclohexane, cyclohexane.getAtom(i), 2);
}
String expected =
"[C]([C]([C]([C,0]([H][H])[H][H])[H][H])" + "[C]([C]([C,0][H][H])[H][H])[H][H])";
String actual = this.canonicalStringFromMolecule(cyclohexane);
Assert.assertEquals(expected, actual);
}
