! 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  -0.8356795440   0.6046232300  -2.9600323206
Cl  -3.3049429886   3.4265126042   0.8444286962
F    3.5300450115  -0.7741520809  -1.0299145648
F    2.1875657885   0.9160814884  -1.0699038698
F    4.6642114145   0.1688790567   1.2924525635
F    3.2907550874   1.8674964071   1.2634021824
O    2.0939209145  -0.4970095937   0.6641018624
N   -1.5833858782  -2.8098161835   0.1303709417
N   -1.1350364535  -3.5152543985   1.1739522538
N   -3.2387832640  -2.8263582124   1.5402699655
C    0.1722312581  -1.2468171149  -0.7177571003
C   -0.7334103397  -2.4612994499  -0.9819904749
C    1.2681463720  -1.6045792789   0.2803955156
C   -0.6515873953  -0.0484685226  -0.3262549628
C   -1.1719102648   0.8303548135  -1.2742241551
C   -0.9953313807   0.1898604810   1.0025937161
C    2.8840603185   0.1061157863  -0.2280326984
C   -1.9827636356   1.9013761169  -0.9318045311
C   -1.8065617275   1.2463609010   1.3793842773
C   -2.8275161975  -2.3962345693   0.3722259613
C   -2.2914488248   2.0981652940   0.4022843075
C    3.9277575978   0.9647314419   0.4854639696
C   -2.1611197878  -3.4973053882   1.9853168222
H    0.6456564663  -1.0629784016  -1.6834137717
H   -1.3786743162  -2.2478691274  -1.8323400364
H   -0.1334661312  -3.3311505447  -1.2466482637
H    0.8633008102  -1.9618014999   1.2237513332
H    1.8770246388  -2.4131126865  -0.1284017078
H   -0.6298516192  -0.4645738745   1.7833588645
H   -2.3651597809   2.5657786247  -1.6939093291
H   -2.0517678749   1.3973351505   2.4210644641
H   -3.3976483905  -1.8091029897  -0.3302182646
H    4.5833054910   1.4819881185  -0.2158391417
H   -2.1322645336  -4.0006025421   2.9388872268
*
