! 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  -0.5408077440   0.2468415425   2.7831121645
Cl  -2.8377863467   3.5912740893  -0.6754806539
F    4.2174953508  -0.5614751502  -0.1083585811
F    2.5177418945  -0.3969147491  -1.4224867594
F    2.1640879507   2.2166364769  -0.7143636076
F    4.1594782990   1.7582321804  -1.4772993325
O    2.2274085956  -0.0795011609   0.7776110459
N   -1.7419040643  -2.8587005099   0.1425488412
N   -1.6970758242  -3.5797669831  -0.9800499898
N   -3.7367528861  -2.6850258905  -0.7034189211
C    0.2884008490  -1.4881652382   0.2534999336
C   -0.5531898594  -2.5862063699   0.9130869596
C    1.6240302358  -1.3593910427   0.9934489485
C   -0.4721192290  -0.1940528460   0.0895086109
C   -0.8953638975   0.6313169432   1.1288389584
C   -0.8128517588   0.2083040091  -1.1996186367
C    3.0377981187   0.0926273515  -0.2693685802
C   -1.6202389291   1.7919578410   0.9086626404
C   -1.5347219537   1.3606222304  -1.4580299201
C   -2.9525962980  -2.3208753324   0.2820303388
C   -1.9332641713   2.1458254481  -0.3917155362
C    3.3232713489   1.5845078116  -0.4284619592
C   -2.9142827633  -3.4521919568  -1.4408206384
H    0.5075721737  -1.8438351020  -0.7546190908
H    0.0244419128  -3.5067282271   0.9890067875
H   -0.8624701408  -2.3163401926   1.9206374660
H    1.4995380318  -1.4320270060   2.0710099340
H    2.2868861245  -2.1735567170   0.6942779279
H   -0.5052359787  -0.4054192680  -2.0363548377
H   -1.9321281296   2.4078793066   1.7406010925
H   -1.7789812805   1.6348654031  -2.4744827340
H   -3.2250317254  -1.6947376584   1.1171250389
H    3.7676775208   2.0162372685   0.4682199828
H   -3.2250388316  -3.9406779640  -2.3507791218
*