! 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  -5.3947436135   1.0498428620  -0.4560009518
F   -0.0927707991  -0.8184323793   1.7303879279
F   -1.9690377198  -1.7619240268   2.1799014032
F   -0.6881591165  -2.5918722196   0.6696326568
O    2.0727080845   1.2966187025   0.9276563877
N    2.4756204587  -0.5332708405  -1.1459785052
N    0.2098191019  -0.6227065875  -1.2105424380
N    3.9415558819  -2.0746271400  -1.7232159502
C    1.2311945475   0.0351719723  -0.8715777426
C    1.2503382542   1.3805722888  -0.1956531045
C    2.1688848448   2.5180463159   1.6326596899
C   -1.0873155487  -0.1800953985  -0.9820355363
C    3.2009527337   2.3810389880   2.7303044536
C   -1.8122960747  -0.5918871436   0.1427404257
C   -1.7223375724   0.6119076943  -1.9356131725
C   -3.1369558035  -0.2085060551   0.3032537396
C    3.7086566312   0.0876765278  -1.1737988066
C    4.6082405911   2.1183825346   2.2144521085
C    2.6891509688  -1.8409055730  -1.4914085634
C   -1.1446428407  -1.4424633642   1.1794583282
C   -3.0415262096   0.9954241451  -1.7788753515
C   -3.7416682600   0.5809435570  -0.6582399648
C    4.5883622878  -0.8763179851  -1.5379462684
H    0.2248893058   1.6673593267   0.0640323425
H    1.6067248777   2.1330955549  -0.9157714273
H    1.1929213639   2.7865918328   2.0587839087
H    2.4544271483   3.3300803796   0.9486132503
H    3.1849712305   3.3107294295   3.3046130986
H    2.8967031097   1.5901141211   3.4216829879
H   -1.1748634191   0.9213545982  -2.8160263532
H   -3.7014483882  -0.5179767909   1.1714988665
H    3.8538216019   1.1306742010  -0.9568702328
H    4.9316413509   2.9054018451   1.5295046445
H    5.3251972007   2.0859549418   3.0357264842
H    4.6778023544   1.1677872080   1.6847910568
H    1.8848747945  -2.5569736332  -1.5357480702
H   -3.5156121086   1.6121927103  -2.5302842866
H    5.6532604596  -0.7772072917  -1.6769804464
*