    Atoms
    1 Mo      -0.979511643420      -0.200182553213      -0.450504020367     R=1.992
    2 O      -2.335063534130      -1.288704027467      -0.368700672799     R=1.72
    3 O      -1.183760204916       1.012669782904       1.096418615963     R=1.72
    4 O      -0.779172490813      -0.094481414665      -2.398414294221     R=1.72
    5 O       0.733261057012       1.668576597911      -0.926886642881     R=1.72
    6 O       0.384749633073      -1.137599028064       0.090892065031     R=1.72
    7 O      -2.505910276698       1.628356935281      -1.064159268212     R=1.72
    8 H      -2.390938825546       2.378279835396      -0.446094628860     R=1.30
    9 H      -2.307339601840       1.993904393939      -1.949213332882     R=1.30
    10 H      -0.120160332057       0.594109031265      -2.629589526368     R=1.30
    11 H       1.629546955537       1.323486074317      -0.737350587513     R=1.30
    12 H       0.581132855053       2.318270224544      -0.210432922212     R=1.30
    13 H      -0.544274591254       0.771285147852       1.798033215322     R=1.30
    14 H      -1.108915373046       1.922382122467       1.393776498637     R=1.30
    End
    GUIBonds
        1 1 6 2.0
        2 1 3 1.0
        3 3 13 1.0
        4 4 10 1.0
        5 5 11 1.0
        6 5 12 1.0
        7 7 9 1.0
        8 7 8 1.0
        9 1 2 2.0
        10 1 4 1.0
        11 14 3 1.0
    End
    NoPrint LOGFILE
    XC
        GGA PBE
    End
    Relativistic Scalar ZORA
    Geometry
    End
    Charge 1.0
    SOLVATION
        Surf Delley
        Solv name=Water cav0=0.0 cav1=0.0067639
        Charged method=CONJ
        C-Mat POT
        SCF VAR ALL
        CSMRSP
    END
    AnalyticalFreq
    End
    NumericalQuality Good
    ScanFreq -1000 0
    QTAIM
        Enabled Yes
    End

