! 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  -5.6370952010   0.0597837672   0.0690691069
O    2.1408381637  -2.1513556035  -1.2376086972
O    0.0979662228  -0.5339511342  -0.9761200162
N    1.1560051428   0.9725743233   0.4317181247
N    1.4319761641   1.9673369562  -0.4171733780
N    1.0970671903   2.7659265006   1.6539692787
C    3.6333401910  -1.0306294317   0.2460094658
C    2.4028179759  -0.8857160566  -0.6781352080
C    1.1022186269  -0.4012452050  -0.0024530183
C    4.0639133121   0.3101708670   0.8492648526
C    3.3813363884  -2.0300567079   1.3766874149
C    4.7967005249  -1.5320203339  -0.6189519503
C    0.9554575549   1.4658157913   1.6570854911
C   -1.2134973283  -0.3893846812  -0.6468620374
C    1.3883340860   3.0152930297   0.3610643536
C   -1.7132723387  -0.4121154562   0.6492113607
C   -2.0856248961  -0.2304240292  -1.7203208599
C   -3.0780772980  -0.2730544135   0.8659487892
C   -3.4447916304  -0.0988401621  -1.5046905631
C   -3.9354485885  -0.1160731664  -0.2071289284
H    2.6563788927  -0.1585539919  -1.4621691085
H    0.8900023930  -1.0096421917   0.8817795776
H    5.0586738404   0.2049418600   1.2852982613
H    4.1226176520   1.1015346602   0.1002323664
H    3.4144287897   0.6487551485   1.6557808067
H    3.1104986038  -3.0179741259   1.0057530701
H    2.5949737833  -1.7012777825   2.0587280906
H    4.2850679023  -2.1463345190   1.9765789380
H    5.0065305054  -0.8417740017  -1.4392862579
H    4.6085876491  -2.5150143955  -1.0476393178
H    5.7027819535  -1.6056203742  -0.0154735506
H    1.5379477691  -2.0436612182  -1.9792106016
H    0.7270426630   0.8489907477   2.5124073468
H    1.5682627909   4.0080144961  -0.0200759513
H   -1.0811579347  -0.5552404095   1.5136452672
H   -1.6970562798  -0.2123442195  -2.7302225684
H   -3.4566339845  -0.2919871689   1.8784762068
H   -4.1114953666   0.0227554332  -2.3471288676
*