! 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   0.5364360643   0.8576963546   2.5670223035
Cl   3.7638346338  -2.1939641522  -0.3887520534
O   -1.1024236515   2.4442768823   0.5863559491
N   -2.4960855174  -0.8817979694   0.1093846789
N   -2.9197018002  -2.4148710223  -1.4199604083
C   -1.2106505203   1.1953143141  -0.0441385026
C   -2.3313323857   0.4367183363   0.6741948951
C    0.0756052483   0.3993652142  -0.0818329163
C    0.8985235589   0.1728277202   1.0178043132
C    0.4379419844  -0.2059419223  -1.2809287701
C   -1.8878259861  -2.0316112983   0.5329733143
C   -3.0807283095  -1.1633612424  -1.0757081992
C   -0.1985528181   3.3431815742  -0.0357913949
C    2.0353915580  -0.6163987654   0.9335798923
C    1.5579676068  -1.0107056833  -1.3970043652
C    2.3508945100  -1.2040114923  -0.2794356269
C   -2.1713480828  -2.9668800706  -0.4166255907
C   -0.6248959786   3.7163476685  -1.4203613059
C    0.1072226334   3.4862158857  -2.5029103981
H   -1.5266649622   1.3249114842  -1.0885352148
H   -2.1287568016   0.3368527979   1.7389778381
H   -3.2653198516   0.9885375850   0.5676602574
H   -0.1801128469  -0.0442678979  -2.1555074304
H   -1.3342949375  -2.0860214236   1.4557890539
H   -3.6295287110  -0.4211151311  -1.6350850339
H   -0.1832656631   4.2264783192   0.6058298281
H    0.8199349958   2.9370587741  -0.0514087092
H    2.6588765368  -0.7722512753   1.8028369655
H    1.8056543815  -1.4706627215  -2.3431327044
H   -1.8801704869  -4.0051339916  -0.4270134265
H   -1.5939674805   4.1976054294  -1.5156505052
H   -0.2277277267   3.7839765687  -3.4880965468
H    1.0760086586   3.0031084394  -2.4443996214
*