! 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  -0.4363949226   1.0423474101   2.7857489550
Cl   4.1331328951   1.2960532309   0.0273400016
N   -1.2412352660  -2.3012362739  -0.3874725700
N   -1.7295795120  -2.6469311437  -1.5819603001
N    0.3482121700  -3.4547331290  -1.3234693916
C   -1.7777034762   0.0778639296   0.1672856878
C   -2.5463253484   0.4908593992  -1.0890450462
C   -1.9415279079  -1.4118644153   0.5095369156
C   -0.3130567934   0.4362220481   0.1363872712
C   -2.4719512618   1.9824123201  -1.4041009404
C    0.3847555170   0.8519511732   1.2688167677
C    0.4327568599   0.2893360043  -1.0326354784
C   -2.9179035572   2.8839272778  -0.2622927948
C    1.7450877196   1.1229633158   1.2523903882
C    1.7918448292   0.5446868667  -1.0853530107
C   -0.0032022728  -2.7778524840  -0.2570026293
C    2.4370610662   0.9641150417   0.0653240192
C   -0.7446503478  -3.3357531620  -2.0991737691
H   -2.2453318869   0.5911682503   1.0095313809
H   -2.2158289711  -0.0787732004  -1.9593487989
H   -3.5922066919   0.2104643692  -0.9330517804
H   -2.9967651532  -1.6811525424   0.5076358108
H   -1.5619043191  -1.6054925672   1.5125445163
H   -1.4564467612   2.2535023575  -1.7050109791
H   -3.0999552971   2.1724277853  -2.2776153511
H   -0.0577335873  -0.0352407049  -1.9415209369
H   -3.9228494443   2.6277604297   0.0800731516
H   -2.9343659164   3.9284341077  -0.5749400032
H   -2.2515277820   2.8217778534   0.6001547512
H    2.2509985828   1.4494072946   2.1503595731
H    2.3340406460   0.4168251712  -2.0116579602
H    0.5936568763  -2.6256098354   0.6287167991
H   -0.8221636871  -3.7798829184  -3.0792671195
*