! 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   0.8962625488   0.3221745694  -2.7314874514
Cl   3.6734517829  -2.7156675411   0.6821612153
O   -1.0005847611   1.9638963946   0.8781066759
N   -2.3661118516  -0.5656792399   0.1470392137
N   -2.3109936921  -2.5508964245   1.1105805723
C   -0.7526170269   1.2519824851  -0.3079622878
C   -2.0022520098   0.4884276846  -0.7672560427
C    0.3868152952   0.2962912718  -0.0621157138
C    1.1687355537  -0.2012634406  -1.0998001688
C    0.6501511210  -0.1830946049   1.2183454113
C   -2.9743870712  -0.4228114372   1.3643905390
C   -1.9687497012  -1.8542349207   0.0590727044
C   -1.5806664477   3.2450748192   0.6893923979
C    2.1831012189  -1.1224152845  -0.8894739785
C    1.6517623104  -1.1068025176   1.4610211433
C    2.4129991416  -1.5666706120   0.4002887938
C   -2.9395366682  -1.6596757184   1.9368997488
C   -0.6064889966   4.2182764968   0.1053230319
C   -0.8387895286   4.9270204123  -0.9919472382
H   -0.4846074761   1.9392051130  -1.1202545477
H   -2.8426171380   1.1735873434  -0.8820305620
H   -1.8270398680   0.0474052582  -1.7480059930
H    0.0605326859   0.1657555491   2.0542646773
H   -3.3904596097   0.5124543839   1.6983227241
H   -1.4510159904  -2.2348562934  -0.8082979423
H   -2.4870929855   3.1957139724   0.0741330992
H   -1.8887770448   3.5726555149   1.6843809316
H    2.7791796730  -1.4818161727  -1.7164030373
H    1.8310901296  -1.4601845021   2.4666414875
H   -3.3405629497  -1.9542645808   2.8938322641
H    0.3298891773   4.3398617587   0.6417596602
H   -0.1184703472   5.6414809128  -1.3687901778
H   -1.7605691105   4.8240343780  -1.5528629897
*