! 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   6.2019594260   0.9102995736  -0.2555623632
O   -2.2852628902  -0.9123523712  -1.3723322583
N   -2.7455318664   1.5221024106   0.1826585457
N   -2.9352803326   1.7513835365  -1.1220177033
N   -2.6113036370   3.6814612237  -0.0392898995
C   -1.8541072560  -0.8367424954  -0.0307465267
C   -2.0777770158  -2.2024639353   0.7060209304
C   -0.3189962961  -0.6020932953   0.0595315180
C   -0.6821351886  -2.7423771405   1.0214474360
C    0.1414644098  -1.4794904270   1.2189857683
C   -3.0605055776  -3.1844727784   0.0550054403
C   -2.7173348119   0.1812831114   0.7360382919
C    0.1907636705   0.8404176829   0.1201963205
C   -2.4877642229  -3.9677986972  -1.1234067307
C   -3.5866909492  -4.1615919018   1.1052366885
C    1.6906591139   0.8913906863   0.0314097028
C   -2.5515484019   2.6794248055   0.8086171215
C    2.4781481046   1.0548179484   1.1668411825
C    2.3306342052   0.7369827733  -1.1961558794
C    3.8640009683   1.0621193881   1.0902045588
C    3.7134706831   0.7416214195  -1.2952352774
C   -2.8397897128   3.0562003206  -1.2054704399
C    4.4698209587   0.9031246373  -0.1448396167
H   -2.5177398801  -1.9443372901   1.6774796932
H    0.0846263456  -1.0515044190  -0.8562341405
H   -0.2738488559  -3.3097933424   0.1812499257
H   -0.6800535191  -3.4025073448   1.8896451054
H   -0.0951355260  -1.0069625784   2.1790055265
H    1.2167160634  -1.6609889182   1.2057118478
H   -3.9156339144  -2.6040241238  -0.3069782017
H   -2.3693914145   0.2778746738   1.7633950367
H   -3.7423981460  -0.1948011063   0.7771011925
H   -0.1237903988   1.3134797009   1.0531899024
H   -0.2282686989   1.4248370186  -0.7029930726
H   -2.4420843785  -0.0111318697  -1.6961714516
H   -1.7479085476  -4.7008006178  -0.7951512415
H   -3.2812257496  -4.5238902532  -1.6267160437
H   -2.0137816161  -3.3290391309  -1.8660999673
H   -2.7796025980  -4.7640917410   1.5287564022
H   -4.3131801691  -4.8517372193   0.6727014635
H   -4.0777837871  -3.6417192124   1.9300025611
H   -2.3789408564   2.7477597478   1.8708650295
H    2.0075699032   1.1795458710   2.1344950135
H    1.7426391552   0.6135566507  -2.0979154962
H    4.4575387767   1.1916355950   1.9849637249
H    4.1909417612   0.6239538897  -2.2584880544
H   -2.9457538814   3.5704912879  -2.1475417425
*