! 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  -0.7998456818   1.4540694784   2.9514524425
F    5.7234474534  -0.2936257597   0.2020644338
O   -0.3332194149   0.8682053438  -1.3348827892
N   -0.6080134341  -1.9990667709  -1.3220690111
N    0.4141895158  -2.7568241346  -1.7256883992
N   -1.1831488576  -2.6800431719  -3.3028000382
C    0.1674971683   0.0630878409  -0.2861892311
C   -0.5083385334   1.3439712960  -0.0153066063
C   -0.5817070569  -1.2421872716  -0.0954997379
C    1.6528959340  -0.0117036534  -0.1745699584
C   -1.9020338916   1.4130184812   0.4906928473
C    2.2302508987  -0.2473470632   1.0695079903
C    2.4699926849   0.1290671382  -1.2887506224
C   -2.1460324610   1.4844603784   1.8580378571
C   -2.9926857457   1.4083128078  -0.3719627776
C    3.6053590912  -0.3433980572   1.2074172485
C    3.8494592395   0.0346397334  -1.1686855129
C   -1.5390558046  -1.9514362590  -2.2740353798
C   -3.4309668701   1.5559666835   2.3680427808
C   -4.2866546404   1.4785442385   0.1222366412
C    4.3902838310  -0.2008367777   0.0790146465
C   -4.5050836929   1.5536344271   1.4898712513
C    0.0181608361  -3.1424635762  -2.9108310859
H    0.1292195659   2.1856727991   0.2514763193
H   -1.6148561091  -1.0713172508   0.2036329458
H   -0.1165659405  -1.8450141449   0.6819498858
H    1.6071775306  -0.3518142747   1.9492660282
H    2.0413549208   0.3116461874  -2.2647914143
H   -2.8295143854   1.3542391275  -1.4400528295
H    4.0561369249  -0.5217398395   2.1744658601
H    4.4893843803   0.1399751452  -2.0345542560
H   -2.4579920284  -1.3963370308  -2.1683588091
H   -3.5939239540   1.6057299061   3.4357655932
H   -5.1233399750   1.4742803160  -0.5627569784
H   -5.5118996879   1.6063330074   1.8809448826
H    0.6218028897  -3.7968774911  -3.5196372999
*