! 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   1.7176842261   0.8951966178  -2.8632026341
Cl  -7.1145725644  -2.9856927259   1.3068643753
O    2.5729571049   0.2750147669   1.5291790159
O    3.2905704821  -0.1011554869  -0.5518801535
O   -2.9977614365   0.1344919749  -1.4577969364
N    4.2149117986   2.3509790991   0.5044100822
N    5.2171777325   2.3096247392  -0.3784117894
N    6.0161860080   2.4984801781   1.7124319623
C    2.4247509728   0.6933852467   0.1990398321
C    3.1675469826  -1.0267576787   1.5572045778
C    2.8438233109   2.1630318523   0.1129526168
C    3.2960424142  -1.3680763006   0.0761311084
C    0.9728033019   0.5362497836  -0.2526870059
C    2.3301303202  -2.0076547118   2.3425606306
C    0.5790771963   0.6025572619  -1.5887299548
C   -0.0358110459   0.3430878986   0.6866704869
C   -0.7411714748   0.4431300688  -1.9741917420
C   -1.3665110414   0.1954600054   0.3334523339
C   -1.7139543580   0.2349804753  -1.0083360216
C    4.7068345529   2.4526816217   1.7398519850
C    6.2679101691   2.4056708064   0.3923736860
C   -3.9188360761  -0.6088923961  -0.7623926589
C   -3.6368780867  -1.8920866211  -0.3114020539
C   -5.1788304325  -0.0574782844  -0.5851866507
C   -4.6232665581  -2.6222986847   0.3317150617
C   -6.1702062758  -0.7926459905   0.0462312917
C   -5.8826424725  -2.0678421909   0.5063070239
H    4.1560323419  -0.9301936413   2.0170039630
H    2.2054696085   2.7487733261   0.7735950738
H    2.7191376180   2.5523159203  -0.8944282385
H    4.2262733140  -1.8792323969  -0.1667801150
H    2.4579850441  -1.9871438851  -0.2683461706
H    2.8058069742  -2.9892075749   2.3248917059
H    1.3304128046  -2.1111431725   1.9183500787
H    2.2360119363  -1.7079250683   3.3860883498
H    0.2163882957   0.3101291030   1.7365862099
H   -1.0181083569   0.4838029778  -3.0190978380
H   -2.1087500284   0.0567212565   1.1077548805
H    4.0848391811   2.5162806311   2.6184317783
H    7.2657654014   2.4142413456  -0.0177421812
H   -2.6607849836  -2.3370383400  -0.4586607410
H   -5.3930325670   0.9405835880  -0.9450168497
H   -4.4045083765  -3.6211864317   0.6836773642
H   -7.1538197384  -0.3630112958   0.1799543036
*
