! 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   0.3547344025  -1.1399033672   2.4068388069
Cl   0.9626795728  -5.3552148900  -0.7878531026
O   -0.6807477636   1.0011998107   0.6560693878
O    0.0750558342   1.1823235789  -1.4517261650
N    1.5974333030   2.6547910636   0.4333246024
N    1.9426350454   3.4561490869  -0.5794034393
N    1.0081205955   4.6449521423   1.0794097505
C    0.3619030396   0.6311502445  -0.1953676449
C   -1.7904853432   1.4374861535  -0.1231751711
C   -1.0958126778   1.9799628153  -1.3619681018
C   -2.7728731287   0.3088378955  -0.4053859694
C    1.6775950653   1.2224683622   0.3367609580
C    0.4968723177  -0.8833882838  -0.3174007241
C   -4.0999577344   0.8011811615  -0.9796335841
C    0.5054126619  -1.7344870881   0.7869315208
C    0.6525883412  -1.4675905950  -1.5711111594
C   -4.9400768277   1.6027933410   0.0058685827
C    0.6455715890  -3.1077056751   0.6518023095
C    0.7962590416  -2.8347550192  -1.7348488936
C    1.0312350693   3.3758108916   1.4029279007
C    0.7879568061  -3.6456300632  -0.6145079013
C    1.5747437564   4.6318301461  -0.1424797673
H   -2.2742180298   2.2352661523   0.4426444969
H   -1.6766120043   1.8551560566  -2.2765366764
H   -0.8393468389   3.0389675499  -1.2606562595
H   -2.9610566437  -0.2341607227   0.5250158647
H   -2.3211505891  -0.4067811655  -1.0993017392
H    2.4988020186   0.9641668942  -0.3286457274
H    1.9122952607   0.8197998764   1.3200117360
H   -4.6726726058  -0.0680058343  -1.3092250626
H   -3.9229420795   1.3959893516  -1.8810288312
H    0.6609630794  -0.8440848930  -2.4529204866
H   -4.4560880265   2.5318023771   0.3103398410
H   -5.9015714253   1.8736607366  -0.4313324153
H   -5.1412067752   1.0263206239   0.9107886930
H    0.6421310350  -3.7441767767   1.5255906121
H    0.9112575566  -3.2537577293  -2.7244651317
H    0.6760727013   2.9458287010   2.3253774916
H    1.7295957690   5.5238352390  -0.7288056321
*