! 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  -4.9580829676  -2.9037353358  -0.7456511372
O    1.5698094889  -1.4194297727  -0.0879458441
N    1.9961401450  -0.1761884573  -0.6010855942
N    3.2548998974   3.8590009226  -0.9637386233
C    1.9966050378   0.6763895486   0.6058827238
C    0.6934790346   0.2667140623   1.3062437868
C    0.5791392181  -1.2135720779   0.9261315047
C    2.0933781576   2.1419478337   0.2555233827
C    3.2025295117   0.3155040974   1.4781222196
C   -0.7995282036  -1.6365845458   0.4776253275
C    1.0646847484   0.2492807970  -1.6390899127
C    1.2898745033   3.1078530406   0.8444864900
C    3.0701204711   2.5888695075  -0.6335341506
C   -1.9093184368  -1.2745788568   1.2380977806
C   -0.9994613577  -2.4175096233  -0.6552833703
C    1.4782733078   4.4423624137   0.5154842903
C   -3.1891588043  -1.6607772125   0.8731187177
C   -2.2750788360  -2.8099054575  -1.0369305518
C    2.4665493823   4.7670170230  -0.3948105625
C   -3.3612307106  -2.4254446439  -0.2697587872
H    0.7363254722   0.4136762915   2.3843134189
H   -0.1618414986   0.8313832205   0.9318870818
H    0.8716234967  -1.8466662072   1.7698769746
H    3.1860776120  -0.7268108876   1.7977278649
H    3.2080139997   0.9339991307   2.3756627610
H    4.1384519667   0.4886084715   0.9464138198
H    0.9706937930  -0.5518743995  -2.3694632109
H    1.4797161793   1.1075084137  -2.1634088499
H    0.0619550624   0.5185925764  -1.2908689302
H    0.5236175870   2.8381343904   1.5590242518
H    3.7358637720   1.8783799945  -1.1112141875
H   -1.7865658702  -0.6763735799   2.1326744534
H   -0.1614167970  -2.7281144339  -1.2634369378
H    0.8662373258   5.2159533328   0.9577335692
H   -4.0381180189  -1.3627316761   1.4728614827
H   -2.4121958856  -3.4094097505  -1.9265576665
H    2.6347082590   5.7996146619  -0.6759084228
*