! 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  -1.8997270921  -0.8272520468  -2.2644912421
Cl  -4.8018948431   3.1210919554  -0.1480893127
F    4.0289218979   1.2166337503  -0.8228296699
F    3.9451866504   0.8985220136   1.3084249459
F    4.6276398844  -1.7401850400   0.9653034823
F    6.0495694189  -0.3111774614   0.1231896225
O    2.5589623207  -0.2567276177  -0.0103589394
N   -1.0208823928  -2.1594456297   0.9790147715
N   -0.9283229125  -3.2278267345   0.1829801073
N   -3.0438890285  -2.9482442139   0.8774385798
C    0.1866640855  -0.2684308830  -0.0148285757
C    0.0912767731  -1.2565163816   1.1548664554
C    1.4216074565   0.6132954137   0.0998769447
C   -1.0589843374   0.5796041492  -0.0881155745
C   -2.0491926327   0.4006941121  -1.0518188075
C   -1.2899835920   1.5616743031   0.8743544754
C    3.7797713476   0.2708479992   0.1178704550
C   -3.2003512561   1.1746200680  -1.0827920368
C   -2.4274724204   2.3488198191   0.8736281982
C   -2.2857468752  -1.9978063153   1.3680569450
C   -3.3739484820   2.1483993816  -0.1166757894
C    4.8156853134  -0.8423165619  -0.0280163961
C   -2.1598318413  -3.6646205492   0.1587829023
H    0.2881856383  -0.8452105877  -0.9357045139
H    0.9964516181  -1.8543068282   1.2374742766
H   -0.0426688542  -0.7309516472   2.1004463641
H    1.4253319986   1.3448940389  -0.7096371107
H    1.4488920993   1.1459097077   1.0523914648
H   -0.5664470285   1.7210763660   1.6636070431
H   -3.9477357035   1.0132930630  -1.8467879140
H   -2.5694284449   3.1008420611   1.6365953415
H   -2.6021989184  -1.1997242254   2.0214331923
H    4.7477018491  -1.3434508789  -0.9934106944
H   -2.4328873067  -4.5472195682  -0.3978919988
*
