! 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   0.0633864196   0.2194263631   2.0293998383
Cl  -4.5548413717  -2.0448406743   0.5841944623
O    3.2975435446  -0.9111283960  -0.3092599725
N    2.0269732861  -1.2731832726   0.0173073063
N    2.4684953735   3.5258108264  -0.2771629210
C    1.3855751861   0.2684051276  -1.8180489317
C    1.1416594778  -0.7183387773  -0.7084457149
C   -0.2637362507  -1.0290897274  -0.3622628442
C    1.3116109893   1.6597239728  -1.2471815179
C   -0.8379290467  -0.6690138747   0.8551212237
C   -1.0697354254  -1.6821786083  -1.2918219026
C    0.0978519479   2.3085312676  -1.0562021649
C    2.4627541835   2.3214072523  -0.8347732087
C   -2.1572930806  -0.9755594270   1.1542900181
C   -2.3869250083  -2.0042990672  -1.0181543988
C   -2.9147347191  -1.6500772017   0.2128596976
C    0.0889622875   3.5632747759  -0.4700845390
C    1.2974546727   4.1275987064  -0.0973384383
C    4.2211917534  -1.5382384410   0.5616174922
H    2.3512893390   0.0990924710  -2.2922283945
H    0.6210288692   0.1421409687  -2.5860066461
H   -0.6527780743  -1.9588387901  -2.2516448210
H   -0.8299175539   1.8424633907  -1.3656306553
H    3.4305193160   1.8513366876  -0.9699902975
H   -2.5839901175  -0.6880246020   2.1049046527
H   -2.9872425225  -2.5226082975  -1.7523578386
H   -0.8362416182   4.0981956851  -0.3070494891
H    1.3221372507   5.1075802000   0.3642771168
H    5.2073238700  -1.1972042025   0.2532254678
H    4.1826186211  -2.6265105219   0.4808876336
H    4.0572099953  -1.2501626878   1.6018563895
*