:: # dependency: {} h2w2o8-ts2.t21
    Atoms
    1.W        -1.957934    0.020790    0.008574
    2.O        -2.867583    1.059942   -1.084914
    3.O        -2.942200   -0.354910    1.420996
    4.O        -1.436897   -1.527111   -0.847899
    5.O        -0.386482    0.776306    0.474112
    6.H        -0.259179   -1.535131   -0.822219
    7.W         1.882951   -0.016589    0.015269
    8.O         2.027027   -0.278287    1.736377
    9.O         0.963500   -1.403456   -0.747065
    10.O         1.763871    1.866794   -0.444099
    11.O         3.496700   -0.255152   -0.599737
    12.H         0.864421    2.151200   -0.204340	    
    End
    NoPrint LOGFILE
    XC
        GGA PBE
    End
    Relativistic Scalar ZORA
    Geometry
        Transitionstate
            Mode 1
        End
        Optim Delocalized
    End
    Charge -2
    SOLVATION
        Surf Delley
        Solv name=Water cav0=0.0 cav1=0.0067639
        Charged method=CONJ
        C-Mat POT
        SCF VAR ALL
        CSMRSP
    END
    NumericalQuality Good
    RESTART
       File h2w2o8-ts2.t21
    END
    AnalyticalFreq
    end
    Scanfreq -1000 0

