! 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  -7.6994365658  -0.9870765920  -0.3670535500
F    3.4382759046  -2.0038963493  -0.0870610189
F    3.2108109450  -0.6638998884   1.5980111811
F    2.2412639580  -2.5547698469   1.5904740779
O    3.6141221981   0.6233554538  -0.6708651515
O   -1.9907114683  -2.2819477678  -0.3562575893
N    3.4770149201   3.1026756288   0.7883198289
N    3.4587804963   4.3383198669   0.2825196457
N    5.4506418471   3.9028680067   1.2070886206
C    2.4066747185   1.3376117473  -0.6040851308
C    1.2652424745   0.3246215568  -0.4963362062
C    2.3504914794   2.2089356148   0.6743894293
C    2.2901660027   2.2190589926  -1.8489783611
C    1.3344831798  -0.9315247794   0.1412102224
C    0.0315493982   0.6866098355  -1.0314004436
C    0.2127333376  -1.7528942699   0.1768295366
C   -1.0879320279  -0.1266377583  -0.9996239519
C   -0.9880748713  -1.3644433470  -0.3937104459
C    2.5657900232  -1.5184249426   0.7994914839
C    4.6722269972   2.8545238893   1.3306075091
C    4.6602770049   4.7786917952   0.5572257831
C   -3.3037350480  -1.9032867437  -0.3711714440
C   -3.7938727065  -0.8900893915   0.4422789577
C   -4.1602800016  -2.6319931784  -1.1821950768
C   -5.1498729567  -0.6035883082   0.4364893121
C   -5.5179759649  -2.3551597882  -1.1781266373
C   -6.0032755635  -1.3384604897  -0.3716850879
H    1.4427913002   2.8109398747   0.6830955962
H    2.3329109428   1.5864089863   1.5657214233
H    2.1897654002   1.6104684402  -2.7480836621
H    1.4582124368   2.9192856562  -1.8116746516
H    3.1902010209   2.8273814908  -1.9590670890
H   -0.0796487333   1.6444601661  -1.5172194420
H    0.2481830618  -2.7259741853   0.6454704609
H    4.2954558893   1.1796721556  -1.0629433091
H   -2.0055135057   0.2152414355  -1.4597347217
H    4.9192336264   1.9195327069   1.8082302088
H    4.9772999891   5.7734353688   0.2846440594
H   -3.1372324902  -0.3259703202   1.0921100534
H   -3.7712280228  -3.4228797826  -1.8100990816
H   -5.5327514530   0.1831289688   1.0720280630
H   -6.1845316593  -2.9290683613  -1.8070092007
*