! 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  -0.1621841387   1.1427276904  -2.5460310467
Cl   3.8704733560   2.5857456316   0.6167874939
O   -2.2716365260   0.1512437958  -0.7373625041
O   -1.6893913205  -0.9627808674   1.1316816132
N    0.1079324855  -2.6102167347  -0.4716744651
N   -0.0962769751  -3.5150195137   0.4900788938
N    2.0947059405  -3.3356335943   0.0339440703
C   -1.2336904406  -0.5661764680  -0.1303915747
C   -3.2621307457   0.4523477569   0.2437643178
C   -3.0831206461  -0.7061340911   1.2092328876
C   -0.9564844328  -1.8027370273  -1.0063755398
C    0.0290286817   0.2709517084   0.0436571418
C   -3.0542290062   1.8271881461   0.8605232553
C   -4.2241662541   2.2373172460   1.7423306941
C    0.5743988575   1.0421548037  -0.9815910190
C    0.7269594712   0.2321420837   1.2478475469
C    1.7498509922   1.7595011413  -0.8135914904
C    1.9038018566   0.9342870174   1.4419120174
C    1.4152359555  -2.5082844074  -0.7197810368
C    2.4043638199   1.6982318335   0.4033013568
C    1.1176182963  -3.9220925699   0.7518435165
H   -4.2339112254   0.4129087094  -0.2539579041
H   -3.3343938942  -0.4680033014   2.2427327373
H   -3.6628454333  -1.5826810365   0.9038188242
H   -0.6817489045  -1.5044901171  -2.0168187464
H   -1.8572120079  -2.4114200782  -1.0780536219
H   -2.1263487861   1.8455265264   1.4399932792
H   -2.9341907099   2.5530988291   0.0530535749
H   -4.0646441752   3.2311613859   2.1596498694
H   -5.1577942669   2.2629576030   1.1776637294
H   -4.3652926176   1.5542951740   2.5816261940
H    0.3487284835  -0.3629824148   2.0658893900
H    2.1456603991   2.3544494947  -1.6248471324
H    2.4177179748   0.8800201792   2.3911173996
H    1.8221195941  -1.8428221695  -1.4652957493
H    1.3075756725  -4.6846656853   1.4906706265
*