! 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  -4.6246049221  -0.2500344713  -0.0313270232
O    1.8741260304  -1.3364770021  -1.1490842381
N    2.8926366599  -0.4072184089  -0.7990577721
N    0.2699372387   2.7263310718  -1.1845434468
C    2.4545576295   0.1222523062   0.5003070049
C    1.9020350329  -1.1349604076   1.1818263797
C    1.1935262202  -1.8157720161   0.0149999705
C    1.3527492383   1.1488086847   0.2693475811
C    3.5849885618   0.7810625396   1.2796795991
C   -0.2783479698  -1.4717523848  -0.0609977775
C    4.1575412885  -1.1226101958  -0.7825538162
C    0.4325306925   1.4524285988   1.2667898177
C    1.2265335724   1.8384762461  -0.9297865606
C   -1.1085854072  -1.8198556849   1.0004995724
C   -0.8286613404  -0.7841475452  -1.1351900558
C   -0.5761735447   2.3631211312   1.0126302582
C   -2.4451653357  -1.4555815386   1.0172709603
C   -2.1638724173  -0.4086855631  -1.1336833540
C   -0.6231656660   2.9643951680  -0.2337575016
C   -2.9596545657  -0.7387033693  -0.0511565880
H    2.7240496068  -1.7481798078   1.5542019022
H    1.2455587907  -0.9403160504   2.0259134228
H    1.3073576156  -2.9036218860   0.0677882748
H    4.0379937940   1.5938030359   0.7106930673
H    4.3637974868   0.0721654841   1.5588037126
H    3.1867746619   1.2074964188   2.1999741618
H    4.9657257519  -0.4102011650  -0.6307583875
H    4.3116774126  -1.5754876323  -1.7603415653
H    4.2405783764  -1.9096701167  -0.0255042062
H    0.4828408314   0.9742860067   2.2365786373
H    1.9271357279   1.6575877744  -1.7336708192
H   -0.7099396901  -2.3702250179   1.8445980688
H   -0.2158235899  -0.5077172990  -1.9806079909
H   -1.3166702253   2.5990615157   1.7639410467
H   -3.0716965059  -1.7219074304   1.8574830644
H   -2.5706223169   0.1428946058  -1.9700941975
H   -1.4068430643   3.6752586018  -0.4680889750
*