! 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  -2.2150844490   0.4946528047  -2.6737278241
Cl  -2.3207376020   5.0346581209   0.1419157267
F    3.1408786507  -1.8380104284  -0.1084916030
F    3.1829142317  -0.1203032029  -1.4177304435
F    3.2090778487  -0.1813252206   2.0897946419
F    3.2695888652   1.5563151574   0.7661762940
O    1.4797951869  -0.3498096025   0.0078161196
N   -0.7964196411  -2.9413481980   0.9575744940
N   -1.7742489454  -3.6944627495   0.4506885160
N    0.0414447590  -4.9449984471   0.8722194789
C   -0.8320238040  -0.8004278615  -0.2524900294
C   -0.9379728787  -1.5115552472   1.0998447359
C    0.5419637341  -0.9600584232  -0.8862287538
C   -1.2085759190   0.6573609858  -0.1518775136
C   -1.8402412621   1.3266061937  -1.1992347078
C   -0.9098089430   1.4104744311   0.9812218247
C    2.7852346991  -0.5281108598  -0.1867223265
C   -2.1881987167   2.6662742454  -1.1252120224
C   -1.2413974765   2.7503233588   1.0875682816
C    0.2767725171  -3.6954773790   1.1916085802
C   -1.8851990303   3.3662352215   0.0290535233
C    3.5827652497   0.2453750731   0.8621197525
C   -1.2242302036  -4.8804846231   0.4224018773
H   -1.5330761540  -1.2965232853  -0.9274310773
H   -0.1761296115  -1.1859135116   1.8051733420
H   -1.9071147400  -1.3096651058   1.5526889428
H    0.7759396428  -2.0157681281  -1.0432340594
H    0.5677215146  -0.4659340016  -1.8594352740
H   -0.4095901654   0.9507336218   1.8216825074
H   -2.6850548548   3.1499757362  -1.9542058167
H   -0.9954608566   3.2996444642   1.9851255356
H    1.1909750970  -3.3044902103   1.6100737957
H    4.6586000497   0.1155628698   0.7403667122
H   -1.7667590171  -5.7424683689   0.0678969164
*