! 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   5.3629636727   2.2396634433  -0.0932640657
O   -2.6128853067  -0.4894422658   1.8821348908
N   -1.1712985483  -2.4422605490   0.1618690411
N   -0.8447829846  -2.6636124122   1.4401050055
N    0.6549648244  -3.6213283569   0.0832094016
C   -2.3875742028  -0.2887355631   0.4943121009
C   -3.6296073273   0.5168345129  -0.0130446156
C   -1.0322638337   0.4454306567   0.3613700604
C   -2.3408511285  -1.6652349166  -0.2010052172
C   -3.4997430613   0.9527168476  -1.4750546680
C   -4.9065763457  -0.3284738226   0.1071937414
C   -3.8274483360   1.7799029365   0.8326933473
C   -0.3440699882   0.5496472138  -1.0074880433
C    1.0883701588   0.9692773472  -0.8269383832
C   -0.2679880129  -3.0149446304  -0.6299495076
C    1.4422126908   2.3154413766  -0.8178786352
C    2.0878488591   0.0253401501  -0.6040534099
C    0.2563188251  -3.3667776549   1.3407344738
C    2.7515375593   2.7162427438  -0.5935693519
C    3.4026730556   0.4040452108  -0.3802206542
C    3.7224986148   1.7525107841  -0.3751988289
H   -0.3344067602  -0.0639311544   1.0327554207
H   -1.1327737824   1.4505600997   0.7774111102
H   -3.2225407668  -2.2470392711   0.0637203424
H   -2.3288055691  -1.5734295444  -1.2852106563
H   -3.2407466939   0.1356913430  -2.1507993237
H   -2.7688974856   1.7484596985  -1.6117032783
H   -4.4574498840   1.3503054887  -1.8166033302
H   -5.7771134714   0.3003069788  -0.0890409760
H   -5.0327688090  -0.7556309905   1.1018458037
H   -4.9430956246  -1.1428357057  -0.6185428384
H   -4.0511189138   1.5560632984   1.8748944487
H   -2.9611208473   2.4424705402   0.8073699987
H   -4.6711811572   2.3492946350   0.4377397007
H   -0.8474544415   1.2731185326  -1.6457138087
H   -0.3745906588  -0.4017879862  -1.5413263240
H   -1.9648474534  -1.1366086285   2.1983510991
H   -0.3252187508  -2.9822406577  -1.7066292053
H    0.6857106678   3.0715656095  -0.9898737555
H    1.8447216680  -1.0307116196  -0.6065958886
H    0.7886739901  -3.7098669973   2.2136358863
H    3.0066719066   3.7672134269  -0.5912467229
H    4.1644559936  -0.3452090068  -0.2132388275
*