! 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   0.7171824824  -0.7514267706   2.2233372459
Cl   4.4137790354  -2.6303479283  -1.1203117352
O   -1.4394898083   0.4674865643  -1.5501076721
O   -1.6721728897  -0.3303036958   0.5333390805
N   -1.7378552969   2.4433054169   0.5288053542
N   -2.3969362646   3.1254158300  -0.4103954731
N   -3.5479581228   3.1232351229   1.5108797324
C   -0.7931650114   0.3406103260  -0.3132556630
C   -0.5154259076   1.7410044035   0.2487307681
C    0.5182169466  -0.4231903592  -0.4893799523
C   -2.6595936072  -0.2595330821  -1.5240229064
C   -2.5151379445  -1.1216686198  -0.2860742792
C    1.2472560514  -0.9354191193   0.5837905183
C    1.0461943449  -0.6115733092  -1.7630308142
C    2.4420950835  -1.6147009098   0.3992509267
C    2.2372259842  -1.2847507138  -1.9764403093
C   -2.4397218011   2.4418594672   1.6647374114
C    2.9257682574  -1.7845186002  -0.8860086047
C   -3.4708879502   3.5185152290   0.2241847533
H    0.0662335079   2.3150426517  -0.4711092110
H    0.0653491743   1.6854962451   1.1676706625
H   -2.7621067699  -0.8425816391  -2.4398193207
H   -3.5047035686   0.4307171019  -1.4510114534
H   -3.4536571390  -1.2942160619   0.2384556148
H   -2.0547528699  -2.0898789726  -0.5112642937
H    0.5151724979  -0.2246702108  -2.6208448141
H    2.9843812436  -2.0041544890   1.2496323338
H    2.6150779381  -1.4138836599  -2.9810630188
H   -2.1028515892   1.9487660642   2.5630913557
H   -4.2279682957   4.1182540579  -0.2570240145
*