! 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   0.8030070856   0.2408038907   2.6807101067
Cl   3.9081686688   3.4080537261  -0.2987759425
N   -1.5189373185  -2.6415768894  -1.0000495382
N   -1.1726789464  -3.6895744707  -0.2496395132
N   -3.2833157929  -3.9120763738  -0.9800410238
C   -0.5592518602  -0.6414856493   0.0669284158
C   -1.8964429028   0.0428184834   0.4008502035
C   -0.6353078805  -1.5151950110  -1.1893498935
C    0.5655398775   0.3594036008  -0.0277400093
C   -2.3921618216   1.0609141163  -0.6186114682
C    1.2332609566   0.8252303113   1.1051954376
C    0.9763989603   0.8899877768  -1.2495302569
C   -3.7292212850   1.6626694161  -0.2111408500
C    2.2569638253   1.7577603619   1.0392360899
C    1.9953337780   1.8221243731  -1.3526685510
C   -2.7763380705  -2.7839274799  -1.4155952931
C    2.6296201798   2.2482112641  -0.1996059107
C   -2.2577768230  -4.4197611362  -0.2737715131
H   -0.3294606486  -1.3186694910   0.8934192286
H   -2.6587185822  -0.7297677010   0.5459151990
H   -1.7965932708   0.5336254084   1.3724508102
H    0.3505612804  -1.8995139255  -1.4486600142
H   -1.0071733941  -0.9703943874  -2.0555603978
H   -1.6580594833   1.8623270569  -0.7331360598
H   -2.4966262114   0.6019918637  -1.6059649065
H    0.4935663196   0.5736994561  -2.1640349048
H   -4.5064621471   0.8993506819  -0.1449826443
H   -4.0625936572   2.4097630045  -0.9321065343
H   -3.6638023287   2.1516336509   0.7624568578
H    2.7537774771   2.0914672628   1.9393977090
H    2.2837193043   2.2050838090  -2.3213526511
H   -3.2714497950  -2.0577743717  -2.0413686166
H   -2.3075098139  -5.3680696045   0.2378321397
*