! 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  -5.6841467722  -0.1006146025   0.0674195611
O    1.9776715686  -2.3357092187  -0.8926337147
O    0.0673152411  -0.5085204032  -0.9764496056
N    1.2160778147   1.0690691925   0.2795866554
N    1.1480092790   1.5530552589   1.5250262184
N    1.5463610562   3.2034348668   0.0603576277
C    3.6024894285  -0.9322716557   0.3042274334
C    2.3271047960  -1.0079964213  -0.5741076430
C    1.0598796274  -0.3427491867  -0.0001761090
C    4.1883553034   0.4840770444   0.3385177023
C    3.3404905653  -1.4085696516   1.7347382142
C    4.6577114558  -1.8411946536  -0.3394257556
C    1.4554081316   2.0635768449  -0.5801722640
C   -1.2470574205  -0.3872317457  -0.6497013157
C    1.3578906167   2.8309504172   1.3418963384
C   -1.7255129391  -0.0301546539   0.6050180619
C   -2.1439108867  -0.6517756154  -1.6825234096
C   -3.0952010425   0.0554547843   0.8214852228
C   -3.5061065217  -0.5662474094  -1.4657583355
C   -3.9767457259  -0.2116291374  -0.2091463405
H    2.5558539378  -0.5233900202  -1.5305060996
H    0.7804893135  -0.8173785020   0.9458662683
H    5.2016466699   0.4458144238   0.7419646543
H    4.2557384113   0.9198356511  -0.6605033592
H    3.6340388200   1.1693039337   0.9772336428
H    2.6737305018  -0.7401326436   2.2813057081
H    4.2780482762  -1.4486831943   2.2914319584
H    2.9126501173  -2.4137419689   1.7741126419
H    4.3823223474  -2.8947643448  -0.3155846391
H    5.6022921722  -1.7419582833   0.1979490529
H    4.8431705276  -1.5658652551  -1.3805695550
H    1.9240963234  -2.8526777292  -0.0802671597
H    1.5476229013   1.9244274008  -1.6454939036
H    1.3643972832   3.5255851850   2.1667152592
H   -1.0692945704   0.1949164617   1.4334510393
H   -1.7711363483  -0.9312714407  -2.6592581738
H   -3.4577090430   0.3364469497   1.8005711582
H   -4.1918798177  -0.7789262942  -2.2742889767
*