! 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 "WATER"
end
*xyz 0 1
Cl  -5.0861795379   1.5205765766   0.5578768293
F   -2.5576519404  -2.3531337294  -1.7153920711
F   -0.5221731703  -1.6729671992  -1.7933584453
F   -1.1567524193  -2.9986692208  -0.2233260553
O    2.2321585144   1.7287286825  -0.4199533621
N    2.5622806098  -0.9855769686   0.4334975948
N    0.3404199692  -0.7690798248   0.8528955743
N    4.6807587451  -1.5671191659   0.2163235559
C    1.3384785257  -0.3597889641   0.1937500045
C    1.3462940936   0.7296709863  -0.8452250012
C    2.4719127950   2.6997017961  -1.4249245447
C   -0.9200582814  -0.1945144028   0.7198584362
C    3.5070171675   3.6879022524  -0.9374790355
C   -1.8918281962  -0.7643161687  -0.1106848034
C   -1.2623539453   0.9117661290   1.4921447130
C   -3.1726102765  -0.2316611758  -0.1618996738
C    2.8023710095  -1.9595564225   1.3835910176
C    3.0851850208   4.4664506902   0.2993169770
C    3.7415709297  -0.7975148372  -0.2366946277
C   -1.5373498051  -1.9478036550  -0.9569071114
C   -2.5376963023   1.4449036769   1.4448737573
C   -3.4863920865   0.8667179662   0.6182520769
C    4.1037011238  -2.2965751640   1.2314578741
H    0.3321758627   1.1191814227  -0.9805505519
H    1.6496478528   0.2988400794  -1.8097858078
H    1.5380467189   3.2187794785  -1.6782852623
H    2.8251019922   2.2085470655  -2.3409617145
H    4.4502283187   3.1662963485  -0.7541145659
H    3.6966674107   4.3796352122  -1.7615786740
H   -0.5221678343   1.3531345771   2.1456970063
H   -3.9271830189  -0.6622519480  -0.8047596920
H    2.0429865890  -2.3078638267   2.0600137244
H    3.8346867108   5.2142963318   0.5589300642
H    2.1423366331   4.9916126515   0.1347346876
H    2.9581845746   3.8193137604   1.1670264398
H    3.8584407381  -0.1004274943  -1.0488358224
H   -2.7829069903   2.3054052040   2.0518192157
H    4.6634250577  -3.0256272084   1.7945350469
*