! 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  -1.4321624435  -0.3115055662  -2.1665454204
Cl  -4.7945649484   3.1172120751   0.1631031892
F    2.9553728879  -0.0036609856  -1.1858621948
F    3.9348544461   1.3633319545   0.1639151715
F    5.2293487994  -0.7266145088   1.3843993215
F    5.5570021333  -0.5851549682  -0.7701286600
O    2.5770541287  -0.1910474502   1.0125464424
N   -1.0749764387  -2.3277982000   0.7461096641
N   -0.7640348846  -3.1914618753  -0.2228989143
N   -2.9867489551  -3.1158780122   0.0769019000
C    0.2019722442  -0.2456707772   0.4828765217
C   -0.0750118973  -1.4803990796   1.3486439134
C    1.3593151993   0.5727614400   1.0491266304
C   -1.0394964508   0.6029092271   0.3688851146
C   -1.8359968042   0.6358159898  -0.7741023899
C   -1.4697057604   1.3616953781   1.4567606614
C    3.4762868076   0.0913704414   0.0645519031
C   -2.9873085644   1.4055624462  -0.8514346340
C   -2.6139758835   2.1378125350   1.4133484112
C   -2.3984716343  -2.2811841181   0.8989912747
C   -3.3618281571   2.1549736697   0.2485624319
C    4.6432722718  -0.8886146929   0.1776638923
C   -1.9377038243  -3.6381415904  -0.5852151910
H    0.4912294307  -0.5887411377  -0.5110370473
H    0.8272044746  -2.0731908368   1.4863678938
H   -0.4295596134  -1.1895798930   2.3377234809
H    1.4570777178   1.5127839901   0.5043370837
H    1.2050716982   0.8183652474   2.0992569748
H   -0.9023389235   1.3483980381   2.3783838611
H   -3.5815062596   1.4128530435  -1.7543159888
H   -2.9134086844   2.7157323118   2.2761144058
H   -2.8833582204  -1.6519320154   1.6289648169
H    4.3239292700  -1.9240678289   0.0609537868
H   -2.0432153544  -4.3817311867  -1.3592790967
*
