! 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  -0.1176283885  -0.6494002436   2.2245066135
Cl   4.1103832094   1.6365643372  -0.0987322801
N   -1.1732823381  -2.1734793931  -0.8154737834
N   -1.6786646251  -2.9980466327   0.1053144626
N    0.4539916479  -3.5349641388  -0.3389420445
C   -1.7450565041   0.1777031737  -0.3130925164
C   -2.6445288122   1.3277699617  -0.7688283833
C   -1.8984308068  -1.0108145194  -1.2698418247
C   -0.2886438718   0.5620642447  -0.2099904424
C   -2.6194769206   2.5278847366   0.1677888246
C    0.5223667688   0.2247202841   0.8707874194
C    0.3293491271   1.2312262251  -1.2662812494
C   -3.5812726718   3.6198100038  -0.2744104462
C    1.8708308175   0.5518807884   0.9211990402
C    1.6709640608   1.5668449498  -1.2534182743
C    0.0976180860  -2.4960250303  -1.0546069698
C    2.4319561089   1.2246218356  -0.1475566281
C   -0.6704926728  -3.7919993761   0.3532124164
H   -2.1034817342  -0.1436374712   0.6668425673
H   -2.3828860281   1.6445153261  -1.7832253700
H   -3.6672878126   0.9448313185  -0.8320343336
H   -1.5357847412  -0.7562775014  -2.2657858796
H   -2.9480004487  -1.2841077090  -1.3648698417
H   -2.8732169335   2.2009137451   1.1803828080
H   -1.6074281523   2.9370122941   0.2240077303
H   -0.2536842611   1.5018156776  -2.1375471422
H   -4.6094202053   3.2550103915  -0.3045732470
H   -3.3327328762   3.9848218764  -1.2726424823
H   -3.5547788053   4.4734847606   0.4031764437
H    2.4685762539   0.2806155209   1.7801402384
H    2.1115673430   2.0867375453  -2.0925602734
H    0.7116369763  -1.9695175335  -1.7683493173
H   -0.7531115691  -4.6016893951   1.0610312406
*