 
    Atoms
    1 Mo       2.016020791211       1.080480701510      -2.374905774275     R=1.992
    2 Mo       0.007015469672      -0.531106103977       0.035296643862     R=1.992
    3 H      -0.582573240827       5.258462981535      -2.309968874882     R=1.30
    4 O      -0.690935032019       4.243502192442       1.144750411287     R=1.72
    5 O      -1.004947536799      -1.907832134427       0.418326450918     R=1.72
    6 Mo       0.881109118725       1.562620745978       5.718751609344     R=1.992
    7 O       3.265574973056       2.312225130967      -2.504551719611     R=1.72
    8 O       2.679075291456       1.275724311989       6.513038971774     R=1.72
    9 O       2.762370598958       2.083051045338      -6.106328349029     R=1.72
    10 O      -0.142164682567       2.462914435138       4.359537809259     R=1.72
    11 O       3.566771713496       2.429832771497       1.420251894596     R=1.72
    12 O       1.626793654449       1.280312703764      -0.230177395677     R=1.72
    13 O      -0.746115172017       6.078751598946      -0.924626931378     R=1.72
    14 O       0.164707602035      -0.493309122016      -1.776142243908     R=1.72
    15 Mo       0.804677163826       2.292661154445      -5.882658258423     R=1.992
    16 Mo       0.347523976799       2.899509983777      -0.148578005665     R=1.992
    17 O       0.907447221826      -0.174818829854       1.894384893980     R=1.72
    18 O       0.966345018664       4.878776827735       3.447806894736     R=1.72
    19 O       1.498692199100       0.862572317849      -4.085140937545     R=1.72
    20 O       0.387497951603      -0.089388628127       5.427506425096     R=1.72
    21 O      -2.208070642648       2.295017006923       2.403135294617     R=1.72
    22 Mo      -1.534689117271       2.981661377515      -2.976866660905     R=1.992
    23 O       2.466598771453       1.294035841279       3.806901667848     R=1.72
    24 Mo      -2.479582976726       5.395340868554       0.095950496153     R=1.992
    25 O      -2.591001842229       6.719439584941       1.264313728816     R=1.72
    26 O       0.833668986000       2.479155305144       1.743730502851     R=1.72
    27 H       1.704688869097       4.256721131521       4.831678725445     R=1.30
    28 O       0.204827249942       0.870049279979      -6.712628315117     R=1.72
    29 H      -2.722742715340       2.944812699709       1.801966970975     R=1.30
    30 H      -1.789807673811       1.681956507795       1.739480648724     R=1.30
    31 O       2.989099098205      -0.480806763881      -1.946775039791     R=1.72
    32 O       3.529568763911      -0.292173733965       1.540290924844     R=1.72
    33 O       0.049675782616       2.005064870950       7.188079827643     R=1.72
    34 Mo       2.265147266112       1.082552049133       2.065126613325     R=1.992
    35 H       0.051905910546       5.783885561608      -0.440750868508     R=1.30
    36 H       2.901763338220       3.614215856903       5.634631096770     R=1.30
    37 O       0.613431548335       3.572971710852      -7.056216093341     R=1.72
    38 H       2.287020977222       3.598000524000      -3.706425222256     R=1.30
    39 O      -1.773410421020       4.742043086770       3.749387797659     R=1.72
    40 O      -1.017158416516       0.951241231918       0.315802121382     R=1.72
    41 O       1.503221915040       4.153200072004      -0.461347178771     R=1.72
    42 O       0.439180676921       2.246947173795      -2.053770511215     R=1.72
    43 H      -1.161636701745       0.555524625328      -2.372817864363     R=1.30
    44 O      -0.718998883656       2.601386351030      -4.701978371860     R=1.72
    45 H       3.509971177438       2.534286034442       0.447107553956     R=1.30
    46 Mo      -0.437569571936       3.873679193888       3.038061636065     R=1.992
    47 H       0.885160491896       4.343691790867      -3.820148451449     R=1.30
    48 O       1.943129368569      -1.658671986940      -0.026431332866     R=1.72
    49 O      -3.154553527238       3.441429721569      -3.392568534783     R=1.72
    50 O      -1.943250469376       1.090314888766      -2.690414812471     R=1.72
    51 O      -0.544361034064       4.722285198187      -3.185687434569     R=1.72
    52 O      -1.424243309281       3.402923767088      -1.066084901258     R=1.72
    53 O      -3.494397605957       5.885929640355      -1.265809145840     R=1.72
    54 O      -3.419809553933       4.046085458456       0.860792281613     R=1.72
    55 H       3.273451273485       0.960731940733       5.800008646212     R=1.30
    56 H       3.011883508541      -0.988137311437       1.010399894002     R=1.30
    57 H       2.560355301613      -1.084017995332      -1.165419383883     R=1.30
    58 H       1.787640381894      -2.616450489801      -0.137996780910     R=1.30
    59 O       1.940803315055       3.783513320026       5.684211327755     R=1.72
    60 O       1.691907523923       4.029268080045      -4.363300190917     R=1.72
    End
    GUIBonds
        1 52 22 1.0
        2 44 15 1.0
        3 3 51 1.0
        4 44 22 1.0
        5 52 16 1.0
        6 11 45 1.0
        7 13 35 1.0
        8 13 24 1.0
        9 14 2 2.0
        10 26 16 1.0
        11 19 1 2.0
        12 20 6 1.0
        13 53 24 2.0
        14 21 30 1.0
        15 21 29 1.0
        16 54 24 2.0
        17 23 34 2.0
        18 25 24 2.0
        19 10 6 1.0
        20 6 23 1.0
        21 15 19 1.0
        22 39 46 2.0
        23 41 16 2.0
        24 38 60 1.0
        25 10 46 1.0
        26 49 22 2.0
        27 50 22 1.0
        28 9 15 1.0
        29 50 43 1.0
        30 4 46 2.0
        31 5 2 2.0
        32 51 22 1.0
        33 42 1 1.0
        34 28 15 1.0
        35 11 34 1.0
        36 42 16 1.0
        37 40 2 1.0
        38 18 46 2.0
        39 31 1 1.0
        40 12 16 1.0
        41 32 34 1.0
        42 33 6 2.0
        43 26 34 1.0
        44 12 1 1.0
        45 36 59 1.0
        46 37 15 2.0
        47 7 1 2.0
        48 40 16 1.0
        49 55 8 1.0
        50 56 32 1.0
        51 57 31 1.0
        52 58 48 1.0
        53 48 2 1.0
        54 60 15 1.0
        55 4 16 1.0
        56 27 59 1.0
        57 59 6 1.0
        58 47 60 1.0
    End
    NoPrint LOGFILE
    XC
        GGA PBE
    End
    Relativistic Scalar ZORA
    Geometry
    End
    Charge -6
    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

