! 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   5.1312250898   0.4585002787   0.9107967111
O   -1.3400257799   0.0425274226   1.1504314384
N   -0.0662903690  -1.9941820813  -0.5265012257
N    0.7070975657  -1.8403640219   0.5549742128
N    1.9401228304  -2.5084462616  -1.1894683089
C   -1.8157819843  -0.2553673077  -0.1401478325
C   -3.3660543529  -0.1119474318  -0.1626193999
C   -1.2993452464   0.7310105498  -1.2443378901
C   -3.6278302147   1.2202804964  -0.8587070698
C   -2.5723939228   1.2162109317  -1.9530527516
C   -4.1062383034  -0.3635136611   1.1595459085
C   -1.4836403345  -1.7115907292  -0.4982379809
C   -0.4904631714   1.9156721348  -0.6969188968
C   -4.1690647309   0.8500289336   2.0825292632
C   -5.5220818747  -0.8594621031   0.8722869068
C    0.9112731862   1.5669939169  -0.2760489328
C    0.6857736031  -2.3802359866  -1.5558800653
C    1.3355827691   1.6769150711   1.0450123101
C    1.8343675690   1.1296829958  -1.2246242370
C    2.6306090190   1.3468363113   1.4193512301
C    3.1315735877   0.7958858597  -0.8726760632
C    1.8979807344  -2.1496498877   0.1049287756
C    3.5171897922   0.9027661211   0.4538417729
H   -3.7187893854  -0.8809490941  -0.8628031943
H   -0.6609380817   0.2025015635  -1.9592791175
H   -3.4711901504   2.0644704185  -0.1816787380
H   -4.6454344581   1.3005547905  -1.2447130195
H   -2.8608418044   0.5089973918  -2.7356675692
H   -2.4339953481   2.1852977787  -2.4355350284
H   -3.5841775007  -1.1655651076   1.6925745143
H   -1.8699390332  -1.9487082984  -1.4882391051
H   -1.9624990988  -2.3898478339   0.2117653785
H   -1.0184931955   2.3999972403   0.1261185199
H   -0.4267440643   2.6582085801  -1.4971251831
H   -0.4322671631  -0.2825402163   1.2372094843
H   -4.5922415374   0.5687785255   3.0489799761
H   -3.1900357421   1.2883258553   2.2666289319
H   -4.8108052017   1.6317558791   1.6702459048
H   -6.0733583013  -1.0419415098   1.7966706187
H   -5.5136705304  -1.7924770023   0.3056126478
H   -6.0913534711  -0.1280532421   0.2934918474
H    0.2801713623  -2.5701625593  -2.5371112827
H    0.6459109636   2.0262673632   1.8032448843
H    1.5417019854   1.0475861483  -2.2648238346
H    2.9381125711   1.4335694538   2.4528365230
H    3.8296057729   0.4541839149  -1.6247072610
H    2.7661986804  -2.1325754743   0.7441343354
*