! 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  -0.4664679986   0.9279854176  -2.4397245610
Cl   3.6806675845   2.6378687441   0.4315603189
O   -2.4605613161   0.0124420708  -0.4180505548
O   -1.7218814630  -1.0526832591   1.4182253106
N    0.1096590561  -2.5645979574  -0.4713448691
N    0.3278827009  -3.2317304116   0.6633309849
N    2.2100400708  -3.1026383327  -0.5440358008
C   -1.3704446156  -0.6758492865   0.1153820056
C   -3.2973723963   0.4379279092   0.6532155847
C   -3.0679244825  -0.6749451119   1.6611526922
C   -1.1494830974  -1.9295648837  -0.7544691790
C   -0.1086613837   0.1836670061   0.1727687464
C   -2.9417098208   1.8235165182   1.1711896668
C   -2.9759627677   2.8975031592   0.0962416840
C    0.3559891716   0.9225438261  -0.9134909741
C    0.6551759841   0.2174996150   1.3359928255
C    1.5141105925   1.6823456760  -0.8423744560
C    1.8172140988   0.9628606561   1.4338913693
C    1.2419284838  -2.4873772727  -1.1765229683
C    2.2352485363   1.6954572913   0.3377919457
C    1.5975384538  -3.5369610168   0.5747909896
H   -4.3222586419   0.4381368979   0.2746743046
H   -3.1640008046  -0.3525731475   2.6987430149
H   -3.7456788509  -1.5186735740   1.4950917336
H   -1.1566744212  -1.6661707668  -1.8099959314
H   -1.9605209354  -2.6379892853  -0.5837632966
H   -3.6642410340   2.0660302739   1.9555587184
H   -1.9613079120   1.8108109148   1.6567200808
H   -3.9535482748   2.9478061298  -0.3877612481
H   -2.7731714544   3.8793953425   0.5249545689
H   -2.2317492208   2.7197282941  -0.6799947332
H    0.3360221930  -0.3514267040   2.1968042083
H    1.8465062932   2.2515339149  -1.6994328549
H    2.3826901485   0.9672532208   2.3552999478
H    1.3064635868  -1.9908848787  -2.1327412960
H    2.1016736945  -4.1005767483   1.3449788717
*