@Test
@Category(SlowTest.class)
public void testPartialTChargeDescriptor_Fluorobenzene() throws ClassNotFoundException, CDKException,
        java.lang.Exception {

    double[] testResult = {-0.1785, 0.1227, -0.0373, -0.0598, -0.0683};/*
                                                                        * from
                                                                        * Petra
                                                                        * online
                                                                        * :
                                                                        * http
                                                                        * :
                                                                        * //
                                                                        * www2
                                                                        * .
                                                                        * chemie
                                                                        * .
                                                                        * uni
                                                                        * -
                                                                        * erlangen
                                                                        * .
                                                                        * de
                                                                        * /
                                                                        * services
                                                                        * /
                                                                        * petra
                                                                        * /
                                                                        * smiles
                                                                        * .
                                                                        * phtml
                                                                        */
    IAtomicDescriptor descriptor = new PartialTChargePEOEDescriptor();
    IAtomContainer molecule = builder.newInstance(IAtomContainer.class);
    molecule.addAtom(builder.newInstance(IAtom.class, "F"));
    molecule.addAtom(builder.newInstance(IAtom.class, "C"));
    molecule.addBond(0, 1, IBond.Order.SINGLE);
    molecule.addAtom(builder.newInstance(IAtom.class, "C"));
    molecule.addBond(1, 2, IBond.Order.DOUBLE);
    molecule.addAtom(builder.newInstance(IAtom.class, "C"));
    molecule.addBond(2, 3, IBond.Order.SINGLE);
    molecule.addAtom(builder.newInstance(IAtom.class, "C"));
    molecule.addBond(3, 4, IBond.Order.DOUBLE);
    molecule.addAtom(builder.newInstance(IAtom.class, "C"));
    molecule.addBond(4, 5, IBond.Order.SINGLE);
    molecule.addAtom(builder.newInstance(IAtom.class, "C"));
    molecule.addBond(5, 6, IBond.Order.DOUBLE);
    molecule.addBond(6, 1, IBond.Order.SINGLE);
    AtomContainerManipulator.percieveAtomTypesAndConfigureAtoms(molecule);
    addExplicitHydrogens(molecule);
    lpcheck.saturate(molecule);
    for (int i = 0; i < 5; i++) {
        double result = ((DoubleResult) descriptor.calculate(molecule.getAtom(i), molecule).getValue())
                .doubleValue();
        Assert.assertEquals(testResult[i], result, 0.012);
    }
}