! 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  -7.6369803843  -0.9652007083  -0.3649701430
F    2.3029189352  -2.5967977977   1.5045247100
F    3.5022405215  -1.9462687438  -0.1340259171
F    3.2126265065  -0.6769823703   1.5936759040
O    3.6101793150   0.6971122026  -0.6421089894
O   -1.9438225962  -2.3404134263  -0.4300241493
N    3.3918541583   3.1322612691   0.8972115839
N    3.3199109428   4.3997017140   0.4803512297
N    5.3780241949   3.9446896098   1.2507817148
C    2.3809524410   1.3758854076  -0.5507016758
C    1.2656933154   0.3315767231  -0.4781743487
C    2.2967781511   2.2022747539   0.7543395661
C    2.2407309375   2.2928573897  -1.7673971392
C    1.3627372000  -0.9459720083   0.1098860083
C    0.0235284774   0.6891444299  -0.9961413015
C    0.2594763898  -1.7934325625   0.1124689522
C   -1.0788913789  -0.1466735715  -0.9921137120
C   -0.9502307359  -1.4053681521  -0.4375934301
C    2.6033046835  -1.5217817722   0.7576169342
C    4.6222529527   2.8773402185   1.3429998061
C    4.5278613213   4.8399031853   0.7179372380
C   -3.2601249322  -1.9525726056  -0.4203172812
C   -3.7394204400  -1.0102987190   0.4795955425
C   -4.1187359439  -2.5908628798  -1.3003881551
C   -5.0901263803  -0.7014988651   0.4916463803
C   -5.4724868117  -2.2923479093  -1.2800705811
C   -5.9470143196  -1.3454544222  -0.3876179662
H    1.3696094667   2.7718387676   0.7807436855
H    2.2998405809   1.5530597646   1.6263878476
H    2.1382834348   1.7102266882  -2.6830370127
H    1.3985184956   2.9783553194  -1.7002513369
H    3.1326216037   2.9143272516  -1.8693633487
H   -0.1085232242   1.6629094658  -1.4426515361
H    0.3164599610  -2.7825662889   0.5430492764
H    4.2762935043   1.2958043603  -0.9946584509
H   -2.0052880979   0.1963689126  -1.4321524502
H    4.9168943423   1.9203487738   1.7430045893
H    4.8074714296   5.8583961608   0.4994568745
H   -3.0775937340  -0.5170209016   1.1793701020
H   -3.7383481398  -3.3263878160  -1.9964642452
H   -5.4654803524   0.0310502897   1.1925006538
H   -6.1429382876  -2.7943245173  -1.9633871528
*
