! 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  -0.0088884606  -2.4315581637  -1.9277955406
Cl  -4.5335588166  -1.5426830859   0.8021764178
O    3.3954022148  -0.5511950578   0.6935157407
N    2.1036129099  -0.9378976255   0.8856830018
N   -0.1361644264   3.6815465550  -0.5151820698
C    1.6540925832   0.4318109068  -1.1390608910
C    1.3050802220  -0.4871437565   0.0027272090
C   -0.1274025690  -0.7937846443   0.2166558098
C    1.4113937787   1.8538288397  -0.7071406044
C   -0.8370628286  -1.6334812513  -0.6363241017
C   -0.8195197610  -0.1977714764   1.2660538685
C    2.3873192901   2.6071682416  -0.0647419998
C    0.1690074882   2.4484852160  -0.9003394249
C   -2.1899704605  -1.8756980199  -0.4693396123
C   -2.1726438531  -0.4207449583   1.4601757247
C   -2.8441304132  -1.2563582083   0.5835502064
C    2.0830630513   3.8966027225   0.3396374210
C    0.8100663222   4.3863113497   0.0953782704
C    4.2297793419  -1.1216941022   1.6857203158
H    2.6872844799   0.2974836257  -1.4554992772
H    1.0224403931   0.1993367237  -1.9970625334
H   -0.2911920023   0.4621223829   1.9408494813
H    3.3719036164   2.1942793024   0.1137041303
H   -0.6179375032   1.8974881680  -1.4053100219
H   -2.7187061911  -2.5373258651  -1.1410499133
H   -2.6907451712   0.0566244409   2.2797239751
H    2.8183028049   4.5149687926   0.8355634743
H    0.5446372738   5.3911933937   0.4012426336
H    5.2354661887  -0.7629746133   1.4768266131
H    4.2271527705  -2.2125569907   1.6404015148
H    3.9419266902  -0.8031409460   2.6894867440
*