! 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   0.3347375987  -0.7729192736  -2.1692973579
Cl  -4.4392055892  -1.2282857279   0.1932998306
O    3.5749461950  -1.3902642720   0.4899488492
N    2.2429450264  -1.6184940956   0.3060771614
N   -0.4808216341   3.4634109585   0.6373140605
C    1.9411162018   0.6537979150   1.2855631536
C    1.5033039144  -0.6559090855   0.6853341739
C    0.0419851060  -0.8464128296   0.5269737208
C    1.2465306044   1.7967486012   0.5999743212
C   -0.5858507565  -0.8972840357  -0.7140082598
C   -0.7598696601  -0.9055266605   1.6635574351
C    1.6022117990   2.1890647529  -0.6846652064
C    0.1952058247   2.4727157015   1.2062584166
C   -1.9627001574  -1.0170160975  -0.8280975055
C   -2.1352053750  -1.0291065448   1.5800141622
C   -2.7226731736  -1.0835464049   0.3266480334
C    0.9073325211   3.2217855322  -1.2908692363
C   -0.1260843128   3.8235484975  -0.5912438936
C    4.3328112455  -2.4533971506  -0.0581941245
H    1.6887317623   0.6503434546   2.3502162224
H    3.0214978295   0.7717840596   1.2215991306
H   -0.2975296797  -0.8575191619   2.6411024451
H    2.4145420417   1.6953996539  -1.2038001173
H   -0.1123568682   2.1976588878   2.2099859882
H   -2.4310150493  -1.0508218305  -1.8016504172
H   -2.7344736228  -1.0791610293   2.4779263002
H    1.1577498105   3.5556460891  -2.2881375249
H   -0.6898625674   4.6325662718  -1.0403187641
H    5.3760305281  -2.2092579301   0.1320104760
H    4.1830485626  -2.5451864452  -1.1358537434
H    4.1005915657  -3.4075616882   0.4189538153
*