@Test
public void testPartialSigmaChargeDescriptor_Methyl_Floride() throws ClassNotFoundException, CDKException,
        java.lang.Exception {

    double[] testResult = {0.07915, -0.25264, 0.05783, 0.05783, 0.05783};/*
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    IAtomContainer molecule = builder.newInstance(IAtomContainer.class);
    molecule.addAtom(new Atom("C"));
    molecule.addAtom(new Atom("F"));
    molecule.addBond(0, 1, IBond.Order.SINGLE);
    AtomContainerManipulator.percieveAtomTypesAndConfigureAtoms(molecule);
    addExplicitHydrogens(molecule);
    lpcheck.saturate(molecule);
    addExplicitHydrogens(molecule);
    for (int i = 0; i < molecule.getAtomCount(); i++) {
        double result = ((DoubleResult) descriptor.calculate(molecule.getAtom(i), molecule).getValue())
                .doubleValue();
        Assert.assertEquals(testResult[i], result, 0.001);
    }
}