! 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   2.4850866186  -0.7808219100  -1.5313452241
Cl   0.1654426803  -5.3374781933  -0.0412478877
O   -0.9841893211   1.1770338548   0.5858778373
O    0.4090444670   1.2825104709  -1.1484484002
N    1.4225686939   2.6363021462   1.0789339473
N    2.2963872551   3.3003261899   0.3179802323
N    0.9464389629   4.7326734690   1.3964132019
C    0.2458923483   0.7103458948   0.1106680073
C   -1.8056919380   1.5608370114  -0.5202497386
C   -0.8824869539   1.3501944617  -1.7216174646
C   -3.0842886209   0.7523141331  -0.5960735159
C    1.3405615779   1.2002825754   1.0592855422
C    0.2553487659  -0.8186726901   0.0550869724
C   -3.9866986711   0.8925293411   0.6221626521
C    1.2027076271  -1.5503855141  -0.6595047363
C   -0.6977666013  -1.5408627429   0.7673557234
C   -5.2555744237   0.0644624629   0.4920011909
C    1.1814759793  -2.9369066623  -0.6971465350
C   -0.7402944272  -2.9243838345   0.7532918249
C    0.6212720409   3.5006680190   1.7029521425
C    0.2011408244  -3.6113841455   0.0083456198
C    1.9746009562   4.5452142705   0.5478871966
H   -2.0451955271   2.6213621240  -0.3926351063
H   -1.1254305274   0.4253187072  -2.2587314743
H   -0.9091295526   2.1760202932  -2.4305827608
H   -2.8417972700  -0.3020971238  -0.7647441288
H   -3.6243056288   1.0859874557  -1.4885425125
H    2.3146547734   0.8121283697   0.7717319809
H    1.1273306662   0.8375202947   2.0643457072
H   -4.2460343788   1.9455096596   0.7654240636
H   -3.4476964614   0.5847742594   1.5219935836
H   -1.4357087532  -1.0136332438   1.3547091024
H   -5.0241861639  -0.9965506957   0.3801670681
H   -5.8927569971   0.1702302133   1.3706115111
H   -5.8414821847   0.3660765800  -0.3782043800
H    1.9223169149  -3.4780789557  -1.2688942331
H   -1.4993132754  -3.4501029471   1.3149957513
H   -0.1598669853   3.1982698717   2.3809968346
H    2.5111735135   5.3591618309   0.0861805801
*