! 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   2.2940133101   1.0446615983  -2.1995153859
Cl  -7.0038822637  -2.7933595263   0.7548660360
O    2.9618721905  -1.0003019094   1.7591366996
O    3.8287242868  -0.3022897281  -0.1626512318
O   -2.4929103370   0.5046987421  -0.9968997539
N    3.3020653625   2.4624639269   0.6475992903
N    2.2048042408   3.2058785198   0.4896726128
N    3.8647477443   3.9743422681  -0.8010809120
C    2.8887748996   0.0251788225   0.8060884134
C    3.4107479963  -2.1931517668   1.1082871519
C    3.3198305891   1.3137343151   1.5129187133
C    3.7562820339  -1.7068480957  -0.3044117305
C    1.4645638391   0.1286774019   0.2551839904
C    2.3691240756  -3.2873907478   1.1381107244
C    1.1190339759   0.5706842201  -1.0195747893
C    0.4118368697  -0.1780067592   1.1161646378
C   -0.2041614924   0.6573539243  -1.4274933728
C   -0.9160609783  -0.0734100826   0.7468335003
C   -1.2202050953   0.3368833857  -0.5436700051
C    4.2820995995   2.9290514637  -0.1311790116
C    2.5878593225   4.0973796920  -0.3871093077
C   -3.5048283440  -0.2981795598  -0.5508995222
C   -4.7299568282   0.3053166226  -0.3094610307
C   -3.3549211303  -1.6713424888  -0.4037144706
C   -5.8136198585  -0.4636748149   0.0839591122
C   -4.4343170072  -2.4385887555   0.0038561492
C   -5.6563107518  -1.8306274000   0.2464154971
H    4.3101400948  -2.5288585412   1.6321393878
H    4.3317591152   1.1839848979   1.8980958494
H    2.6597276086   1.5117667666   2.3561580462
H    4.7176295186  -2.0739291694  -0.6616199504
H    2.9861331640  -1.9950590887  -1.0307916030
H    1.4536258520  -2.9918008326   0.6233553552
H    2.1148052594  -3.5679142019   2.1605743791
H    2.7596755050  -4.1777934000   0.6419728745
H    0.6325434843  -0.5081333858   2.1219523775
H   -0.4479407585   0.9865991912  -2.4290407251
H   -1.6902937731  -0.3082236807   1.4651176007
H    5.2650077080   2.4862910087  -0.1679326937
H    1.9225928875   4.8714537236  -0.7373909618
H   -4.8421531104   1.3746964512  -0.4336219491
H   -2.4091696565  -2.1571022468  -0.6071420327
H   -6.7681668752   0.0096525142   0.2694897650
H   -4.3160062761  -3.5071735233   0.1214091926
*