! 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  -0.2265403310   0.0014279219  -1.9698171235
Cl  -4.4923267423  -1.6586898532   0.7980901497
O    3.4515517263  -1.2174098480  -0.1445029217
N    2.1214965053  -1.5194258634  -0.1484393128
N    1.7624487589   3.2731802112  -1.2437157678
C    1.8837916153   0.5032730206   1.2886966514
C    1.4149679209  -0.7098153576   0.5315786199
C   -0.0445932109  -0.9698982382   0.5535409263
C    1.4111487621   1.7344207052   0.5647632781
C   -0.8782820164  -0.6688639807  -0.5193516505
C   -0.6282614062  -1.4764160194   1.7108607988
C    0.2168485020   2.3666943266   0.8795134711
C    2.1357599932   2.2323488822  -0.5129408609
C   -2.2481678496  -0.8760820260  -0.4552417480
C   -1.9906411556  -1.7009694219   1.8004193491
C   -2.7874827014  -1.3953051911   0.7089827571
C   -0.1917026620   3.4503982488   0.1180267135
C    0.6122213859   3.8624919792  -0.9305325633
C    4.1674967537  -2.1585941595  -0.9230350674
H    1.4562240660   0.4754819964   2.2933514197
H    2.9664153409   0.5134294840   1.3977769263
H   -0.0004436325  -1.7073071339   2.5617331178
H   -0.3863673639   2.0207078298   1.7099936931
H    3.0719994000   1.7596746655  -0.7922172309
H   -2.8804064251  -0.6327671428  -1.2975769952
H   -2.4194824417  -2.1053474186   2.7062130077
H   -1.1160263507   3.9680213839   0.3332750213
H    0.3193522115   4.7073382971  -1.5423645656
H    5.2130878561  -1.8623317952  -0.8679106815
H    3.8515971625  -2.1456034733  -1.9680637531
H    4.0671183386  -3.1724807204  -0.5304021008
*