! 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 "1-OCTANOL"
end
*xyz 0 1
Cl   0.3548950554   0.2551646061   2.5511887347
Cl   4.0144278503   3.2118713114   0.0226372121
N   -1.2954148697  -2.8275257584  -0.7275548516
N   -2.0090864177  -3.1111944164  -1.8185562538
N   -2.6990841318  -4.3550771832  -0.0905952707
C   -0.7931490837  -0.4330629749  -0.2722758786
C   -1.8936941124   0.1175447134  -1.1834499131
C   -0.2729302550  -1.8061534266  -0.7256287845
C    0.3955367150   0.4927293029  -0.1641038662
C   -2.4541767515   1.4673792720  -0.7437232141
C    0.9816495593   0.8532051672   1.0472344511
C    0.9936346416   0.9975433102  -1.3186652658
C   -3.0943948836   1.4497530052   0.6373369807
C    2.0873652134   1.6892672983   1.1202011462
C    2.1008931474   1.8256966064  -1.2834724254
C   -1.7188960078  -3.5737396649   0.2948188918
C    2.6368617345   2.1702192801  -0.0537031286
C   -2.8351434376  -4.0323114087  -1.3911349403
H   -1.2202941497  -0.5710767103   0.7226509370
H   -1.5293715787   0.1911996028  -2.2121131023
H   -2.7134893487  -0.6044474281  -1.2131830003
H    0.5262302797  -2.1375298362  -0.0622451924
H    0.1411067906  -1.7582577889  -1.7323835701
H   -1.6727251525   2.2318868182  -0.7769419931
H   -3.2023509988   1.7744777745  -1.4787447229
H    0.5825350104   0.7386749128  -2.2863172899
H   -3.8640750279   0.6778220562   0.7092600045
H   -3.5686672257   2.4065243161   0.8602721254
H   -2.3686128913   1.2638250338   1.4309263899
H    2.5106048153   1.9555532528   2.0787544280
H    2.5346541278   2.1950935679  -2.2023361037
H   -1.2867222886  -3.5195682223   1.2823620395
H   -3.5621482483  -4.4913873265  -2.0431069494
*