! 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  -5.1446650911   1.4788418676  -0.2311121373
F   -0.2775602214  -1.6242558900   1.5851434610
F   -2.2902616597  -2.3679828000   1.6702378650
F   -1.0159437928  -2.9159601228   0.0323436207
O    2.1898367714   1.9335705707   0.0881408656
N    2.5618972628  -0.7638045544  -0.8805693343
N    0.3080876039  -0.5948530892  -1.0893997413
N    4.7077617608  -1.2834253906  -0.8840820938
C    1.3510058394  -0.1835710265  -0.5049066910
C    1.4186099239   0.8650287838   0.5744867185
C    2.0755791062   3.1141201996   0.8689867431
C   -0.9512005068  -0.0692871612  -0.8185490673
C    2.5961959908   2.9868247370   2.2896316250
C   -1.8257085821  -0.7046735815   0.0705244731
C   -1.3954170588   1.0551323096  -1.5084489830
C   -3.1149470532  -0.2236266984   0.2530053075
C    2.7342167388  -1.7189302131  -1.8644083565
C    4.0442910095   2.5334130449   2.3791931158
C    3.7964632333  -0.5483892742  -0.3296020495
C   -1.3581466015  -1.9037654561   0.8359987991
C   -2.6790021543   1.5381372712  -1.3291530626
C   -3.5325972983   0.8909163068  -0.4517553670
C    4.0536627454  -2.0173948249  -1.8477812571
H    1.8431088098   0.4177602081   1.4826209922
H    0.4028069347   1.1869129934   0.8264176278
H    1.0298672250   3.4471881357   0.8864630632
H    2.6493818679   3.8705884988   0.3305332174
H    2.4913228383   3.9742646454   2.7461452008
H    1.9571249962   2.3224398886   2.8780296804
H   -0.7294439553   1.5492236635  -2.2027818875
H   -3.7950612269  -0.7073371430   0.9396372465
H    1.9215475856  -2.0833973866  -2.4662162833
H    4.7035099878   3.1825426091   1.8002965459
H    4.3926152105   2.5447982912   3.4120110383
H    4.1827102308   1.5153803779   2.0135917324
H    3.9719977739   0.1484155087   0.4715365988
H   -3.0059378138   2.4128647475  -1.8742079166
H    4.5759766468  -2.7232422442  -2.4728247518
*