! 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   2.4861405896   0.7202796131  -2.7483160259
Cl  -7.0876824016   1.2386202522   1.6322574114
O    3.8066843526   1.1467802197  -0.1578860570
O    3.0648773041   0.1243657789   1.6870778860
O   -2.3261573340   0.1753351380  -1.6054287906
N    2.9451660040  -2.3968322371   0.1778066824
N    2.9326038207  -2.8996282488   1.4137250432
N    1.5156838132  -4.0260667279   0.0948862680
C    3.0381549799   0.0676169623   0.2956615527
C    4.0482016827   2.0518426961   0.9218008074
C    3.7184230181  -1.2313949955  -0.1584818813
C    3.1506327498   1.4986708958   2.0224165853
C    1.6027189739   0.1437734522  -0.2224670867
C    5.5192292403   2.0638057636   1.2779107245
C    1.2712480372   0.4210493959  -1.5473081061
C    0.5476627357  -0.1502807209   0.6367336108
C   -0.0424910641   0.4525281192  -1.9844633409
C   -0.7742256719  -0.1413522010   0.2265292413
C   -1.0670487119   0.1736064231  -1.0922380290
C    2.0908621049  -3.0728495179  -0.5953743335
C    2.0650429677  -3.8734748754   1.3161865020
C   -3.4030574414   0.4284582679  -0.7995047490
C   -4.4844724987  -0.4340436604  -0.8829877332
C   -3.4507417462   1.5444827936   0.0254068836
C   -5.6267217575  -0.1814217342  -0.1390532157
C   -4.5864031894   1.7905829524   0.7793231381
C   -5.6667484535   0.9257293740   0.6924705910
H    3.7279585562   3.0506196700   0.6153048404
H    4.7018544582  -1.3120398756   0.3038050035
H    3.8565547057  -1.2169800111  -1.2380843352
H    3.5751811050   1.5875557437   3.0219260258
H    2.1633740625   1.9736794551   2.0199953014
H    5.8482462102   1.0974494648   1.6654268987
H    6.1318485888   2.3107493798   0.4101012315
H    5.7138884754   2.8170212038   2.0425606048
H    0.7601252012  -0.4062554736   1.6655498167
H   -0.2742828790   0.6836037918  -3.0158955273
H   -1.5519892053  -0.3900615017   0.9361122777
H    1.9328699689  -2.8433583697  -1.6379768273
H    1.8241044191  -4.5053008841   2.1570288264
H   -4.4414803334  -1.2987781702  -1.5324136252
H   -2.6147599807   2.2297031871   0.0849161120
H   -6.4720057339  -0.8522940482  -0.2081574259
H   -4.6246678859   2.6591627473   1.4223879492
*