! 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  -6.7187148493   0.4856496759   0.4412398692
F    2.7770195458  -2.9755930245   1.0037801679
F    4.1648595284  -1.7675149323  -0.0659404237
F    3.3267582287  -1.0838142245   1.8151535239
O    4.0632094785   0.8888012278   0.1177163677
O   -1.5712011977  -2.1167198934  -0.5905599592
N    1.7226030415   2.7139588576   0.2378215792
N    2.0959483874   2.3744048628   1.4756519389
N   -0.0581915117   2.9603196738   1.4523401195
C    3.1468174758   1.0616316175  -0.9287936806
C    1.9637227749   0.0856187923  -0.8559904340
C    2.6268389293   2.5202592483  -0.8720986134
C    3.9055639043   0.8698171455  -2.2367729099
C    1.8905840047  -1.0893098936  -0.0905003375
C    0.8415889451   0.4086398145  -1.6218677337
C    0.6884297553  -1.7937045562  -0.0096957662
C   -0.3388058171  -0.3030018924  -1.5743435064
C   -0.4232528156  -1.3864660412  -0.7185893927
C    3.0490447896  -1.7044879135   0.6624430317
C    0.4331565195   3.0504046429   0.2375054480
C    0.9975498416   2.5387439960   2.1707318688
C   -2.7429484885  -1.4597777868  -0.3412272192
C   -2.8014752181  -0.2757902910   0.3844978945
C   -3.9067884405  -2.0513634430  -0.8124733394
C   -4.0286233383   0.3228365687   0.6234134249
C   -5.1335318625  -1.4580371811  -0.5641444834
C   -5.1865966410  -0.2688440511   0.1459698138
H    3.4857914827   3.1830963126  -0.7569947436
H    2.1101359756   2.8236390671  -1.7793227194
H    4.7019171388   1.6100969421  -2.3347191310
H    4.3572840639  -0.1209491032  -2.2769205431
H    3.2450391502   0.9688570896  -3.0976207798
H    0.8732432502   1.2588115769  -2.2896607177
H    0.5978693060  -2.6763161637   0.6073671073
H    3.6706830269   1.2490921927   0.9292111879
H   -1.1796049674   0.0016851124  -2.1843184682
H   -0.0945972833   3.3556831367  -0.6521273030
H    0.9601446266   2.3500690206   3.2322460430
H   -1.9061506657   0.1927152063   0.7732672893
H   -3.8566850500  -2.9764583037  -1.3722634239
H   -4.0713720305   1.2454964206   1.1861481697
H   -6.0381493536  -1.9213719049  -0.9336713112
*