! 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   0.5585471572  -1.6979315884  -1.8963046706
Cl   4.8896975365   1.0246555076  -0.4101759950
O   -1.3194644757  -1.5189167039   0.3657661343
O   -1.4043527812   0.3204691629   1.6225830985
N   -1.3576923004   1.9072535384  -0.8908408547
N   -0.4624547430   2.2347372725  -1.8282163523
N   -0.8625897451   3.9836919872  -0.4805024048
C   -0.9875043296  -0.1642169484   0.3796918604
C   -1.4456906427  -1.9907766023   1.7085233027
C   -1.1855073092  -0.7354919886   2.5449286917
C   -2.8213235617  -2.5902294544   1.9275264676
C   -1.7961483309   0.5469323089  -0.7125546211
C    0.5114558345   0.0701403545   0.1888974651
C   -3.1349217965  -3.7743247546   1.0230164530
C    1.2631454681  -0.5554603722  -0.8023304802
C    1.1611925361   1.0171836048   0.9751021292
C   -4.5179753875  -4.3489225434   1.2905783444
C    2.6079542173  -0.2746390563  -0.9899711421
C    2.5009829592   1.3226013983   0.8082420994
C   -1.5719358301   2.9535544835  -0.0901791383
C    3.2150976252   0.6656020859  -0.1769024845
C   -0.2031613196   3.4829669680  -1.5428036701
H   -0.6761781828  -2.7466660354   1.8934103568
H   -1.8808910517  -0.6190179212   3.3755401580
H   -0.1655952418  -0.7130683823   2.9410056351
H   -3.5808336333  -1.8101105603   1.8050736950
H   -2.8736906682  -2.9113394204   2.9725071732
H   -2.8522531629   0.5371313624  -0.4432254550
H   -1.6868782917   0.0331090834  -1.6642458733
H   -2.3800705354  -4.5525556891   1.1707962752
H   -3.0638406645  -3.4715236172  -0.0241020023
H    0.6116178698   1.5428461539   1.7432525788
H   -4.6212359319  -4.6715554004   2.3284009962
H   -5.2978301905  -3.6096980803   1.0979668642
H   -4.7209255027  -5.2126214273   0.6564491970
H    3.1677723386  -0.7783205017  -1.7654330357
H    2.9712705023   2.0642911810   1.4381644399
H   -2.2580881720   2.9292878702   0.7409988868
H    0.4894964431   4.0621934118  -2.1328317848
*