! 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  -0.9186795704   1.2218160220  -2.7258483673
Cl  -4.9130606196   2.8279999560   0.4342642476
F    3.2749323526   0.8260870322  -0.4112957566
F    3.8189400800   0.5193255269   1.6523731839
F    5.7059127214  -0.3041461428  -0.0942133625
F    4.2810493436  -1.6412327572  -1.0700918700
O    2.3539665535  -0.8764694922   0.7118789960
N   -1.0002451713  -2.3491100941   0.1337492709
N   -0.5793240882  -2.9398017298   1.2570687915
N   -2.8180658374  -3.0079564005   1.1291280913
C    0.2372807968  -0.2298455018  -0.2725897976
C   -0.0984049698  -1.6516016159  -0.7505150831
C    1.1137010781  -0.2000792142   0.9760611612
C   -1.0266410926   0.5698924011  -0.0873112696
C   -1.6343545471   1.2423650553  -1.1475147957
C   -1.6851432782   0.6130892538   1.1401976399
C    3.4534847920  -0.1407570948   0.5241001981
C   -2.8225078240   1.9398754368  -1.0025219988
C   -2.8727256612   1.3017597289   1.3194361611
C   -2.3320502747  -2.3857766812   0.0826220361
C   -3.4303418653   1.9632250404   0.2401777931
C    4.6014426844  -1.0571627887   0.1059223292
C   -1.7017258987  -3.3174934321   1.8129459586
H    0.8158035517   0.2192034650  -1.0820791729
H   -0.5722813385  -1.6037648158  -1.7297687411
H    0.8053115565  -2.2466727090  -0.8673610597
H    1.2762372693   0.8308499920   1.2942590824
H    0.6700422327  -0.7320259464   1.8144105753
H   -1.2720153659   0.0966323904   1.9964730331
H   -3.2632203450   2.4527481020  -1.8456958467
H   -3.3517631074   1.3127992780   2.2879730429
H   -2.8998426348  -1.9699882777  -0.7345926352
H    4.8101230018  -1.8232868126   0.8522151556
H   -1.7146133764  -3.8505494997   2.7505100059
*
