! 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  -5.0780636225   1.5097930359  -0.3321998249
F   -1.0449803871  -2.9572168838   0.2092850258
F   -0.2814513182  -1.5752275166   1.6694873569
F   -2.3076799047  -2.2739871709   1.8045283104
O    2.2199452009   1.8421272133  -0.1045554819
N    2.5767202897  -0.9126679405  -0.8467849763
N    0.3183536083  -0.7517114064  -1.0760751931
N    3.9762514757  -2.3195222888  -1.8137475933
C    1.3642200233  -0.3023220108  -0.5252129136
C    1.4399701904   0.8242580628   0.4685189187
C    2.2782855733   3.0239365747   0.6776248758
C   -0.9318515068  -0.1856871473  -0.8442072837
C    2.9867692923   2.8611770597   2.0118364934
C   -1.8133824188  -0.7341772042   0.0940204934
C   -1.3556219682   0.8956097874  -1.6115036988
C   -3.0883246088  -0.2083742616   0.2519052393
C    3.8246995751  -0.6640546153  -0.3048817981
C    3.1085306927   4.1999533749   2.7242271473
C    2.7428340863  -1.9271454831  -1.7513323242
C   -1.3677068188  -1.8857769881   0.9408892416
C   -2.6249739359   1.4227675475  -1.4573031688
C   -3.4848833293   0.8635720182  -0.5271188263
C    4.6607783082  -1.5387416953  -0.9101729022
H    1.8662338364   0.4383359583   1.4026629068
H    0.4309207108   1.1787249414   0.7036496737
H    1.2652405207   3.4168440910   0.8388864018
H    2.8124922331   3.7504825879   0.0622554270
H    2.4427908624   2.1651184271   2.6553586919
H    3.9804179407   2.4349291536   1.8482150817
H   -0.6839160597   1.3221682551  -2.3440787523
H   -3.7729966680  -0.6237698103   0.9774323860
H    4.0129723627   0.0865144303   0.4413763481
H    3.7012306774   4.9090427455   2.1443528697
H    2.1291805845   4.6495375501   2.8968963797
H    3.5900697390   4.0828928105   3.6945991185
H    1.9231947402  -2.3236375042  -2.3260621598
H   -2.9350440447   2.2643352303  -2.0611450837
H    5.7206204136  -1.6504357133  -0.7497139989
*