! wb97x-d3
! def2-TZVPP
! def2/J RIJCOSX GRIDX6 NOFINALGRIDX
! grid4 nofinalgrid
! scfconv7
! smallprint printgap noloewdin
! NOSOSCF
%MaxCore 8000
%output
       print[P_BondOrder_M] 1
       print[P_Mayer] 1
       print[P_basis] 2
end
%pal
    nprocs 8
end
%cpcm
    smd    true
    smdsolvent "WATER"
end
*xyz 0 1
Cl   0.6423914876  -0.1698208349  -3.1676294680
Cl   3.7358538908  -2.7360226087   0.3617395134
O   -0.7149427181   2.1539515628   0.3084833727
N   -2.2538887173  -0.3343680456   0.2443271265
N   -2.7334184017  -0.8242411046   2.3421113641
C   -0.6448989476   1.2471172138  -0.7603878690
C   -1.9651672971   0.4784648197  -0.9123986916
C    0.4920638619   0.2938547570  -0.4943154844
C    1.1117789638  -0.4190047037  -1.5150688252
C    0.9107005675   0.0333958493   0.8076937578
C   -1.8747168543  -1.6360396959   0.4372942660
C   -2.7415606382   0.1077429809   1.4241963676
C   -1.3201089919   3.3853139531  -0.0025590566
C    2.1114432868  -1.3482094172  -1.2719855368
C    1.9038689688  -0.8896059617   1.0846760154
C    2.4957372511  -1.5745220825   0.0374383004
C   -2.1877345275  -1.9211358102   1.7315544354
C   -1.5941649648   4.1614575799   1.2380214664
C   -1.4462345727   3.7326041950   2.4847602663
H   -0.4701719535   1.7782310413  -1.7049788643
H   -2.7901810449   1.1745568256  -1.0710525443
H   -1.9286626310  -0.1630806513  -1.7916018529
H    0.4508340774   0.5533362117   1.6360946370
H   -1.4380927012  -2.2320925227  -0.3464666057
H   -3.1197101129   1.1100256164   1.5491418440
H   -0.6739643316   3.9749758766  -0.6683448971
H   -2.2669196228   3.2523205917  -0.5448579233
H    2.5757916773  -1.8810763799  -2.0893848673
H    2.2030468266  -1.0711366673   2.1070443086
H   -2.0510870548  -2.8566957829   2.2497790600
H   -1.9542926417   5.1692714261   1.0582465748
H   -1.6820655861   4.3823402656   3.3169974700
H   -1.0963550771   2.7391225565   2.7326203188
*
