! 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   0.0365960988  -2.0207936117   0.4828787352
Cl  -7.5798447916   0.3359437829  -1.7871845348
O    2.6658406359  -1.1992822107  -0.5830233334
O    3.5306579741   0.7847649631  -0.0437400440
O   -2.5396981721   2.3412082300   0.4156072933
N    4.2133924502  -1.2962051604   1.7785331751
N    4.3209508349  -2.6191079812   1.6428977953
N    6.3476785595  -1.6824439802   1.8054454853
C    2.5738388789  -0.1560043078   0.3384797716
C    3.3738950269  -0.7629041846  -1.7422073510
C    2.9357973399  -0.6380296530   1.7468896146
C    3.6175609129   0.7175413140  -1.4558986055
C    1.1752615457   0.4605324535   0.3477008661
C    4.6435543106  -1.5668320357  -1.9197071117
C    0.0025209269  -0.2903886910   0.3958626200
C    1.0325498279   1.8459238511   0.3387134429
C   -1.2533150189   0.2987106385   0.4086565508
C   -0.2053776842   2.4607995634   0.3344138046
C   -1.3519512681   1.6817515957   0.3638213964
C    5.4289885975  -0.7493154424   1.8684063460
C    5.6146913081  -2.8063524089   1.6687665403
C   -3.6806157670   1.8065729206  -0.1145205234
C   -3.7051858702   1.1833044284  -1.3553379789
C   -4.8507771524   1.9801054326   0.6096782331
C   -4.9087803681   0.7242241305  -1.8665106326
C   -6.0560566352   1.5335109950   0.0926678768
C   -6.0763446916   0.9027436502  -1.1409873566
H    2.7292351526  -0.8897081369  -2.6160477802
H    2.1903954751  -1.3330391121   2.1257539233
H    2.9576534041   0.2187434051   2.4204545608
H    4.6048408160   1.0639325309  -1.7609390552
H    2.8642525341   1.3552530414  -1.9307875643
H    5.3560172488  -1.3833566518  -1.1134954583
H    4.4333878377  -2.6360024768  -1.9547881078
H    5.1248575025  -1.2936840561  -2.8599628529
H    1.9155827244   2.4697189989   0.3246621197
H   -2.1362937743  -0.3243803290   0.4629941568
H   -0.2820099549   3.5399740551   0.3141809752
H    5.5920257963   0.3098442301   1.9890054111
H    6.0493145131  -3.7908534204   1.5891111267
H   -2.8012687278   1.0557460860  -1.9370568508
H   -4.8242740815   2.4728076288   1.5730608267
H   -4.9288360812   0.2385706087  -2.8326180087
H   -6.9679857412   1.6754723174   0.6564144807
*