! 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  -5.6869161294  -0.0140154029   0.0471743007
O    1.9323258084  -2.4030161972  -0.6608443360
O    0.0599733759  -0.5885479497  -0.9258470099
N    1.2108442012   1.0378622283   0.2577544806
N    1.1802423617   1.5683323017   1.4847476479
N    1.4937774704   3.1660947892  -0.0571329941
C    3.6262380660  -0.9072051739   0.2882858133
C    2.3212794512  -1.0527526398  -0.5370462044
C    1.0617254719  -0.3829333010   0.0333483233
C    4.2010637410   0.5110000541   0.2013172986
C    3.4264659310  -1.2958819882   1.7524517988
C    4.6623084163  -1.8511975023  -0.3382163491
C    1.3976111714   2.0017053645  -0.6489788157
C   -1.2519831365  -0.4257417794  -0.6108710457
C    1.3605443456   2.8409664217   1.2450653119
C   -1.7349418417  -0.0627174845   0.6400862005
C   -2.1418692466  -0.6580277152  -1.6570798591
C   -3.1049703947   0.0607947229   0.8380306392
C   -3.5035410341  -0.5347713698  -1.4585382932
C   -3.9801159395  -0.1739107005  -0.2061084677
H    2.5112489491  -0.6142642446  -1.5290266694
H    0.8023007764  -0.8272223748   0.9989214573
H    4.2320425548   0.8770827473  -0.8273461966
H    3.6620265919   1.2366262389   0.8082003762
H    5.2277761758   0.5098971548   0.5717675201
H    4.3832639853  -1.2774355543   2.2778262857
H    3.0190534504  -2.3027566256   1.8551552296
H    2.7639151409  -0.6071278185   2.2792524891
H    4.7860930304  -1.6670603630  -1.4088299711
H    4.4141887307  -2.9043237169  -0.1993720877
H    5.6354705366  -1.6956773941   0.1291150025
H    2.5235880551  -2.8354524461  -1.2840298317
H    1.4509316722   1.8224169952  -1.7110568443
H    1.3885682518   3.5679862374   2.0410211346
H   -1.0817070540   0.1343638065   1.4784410549
H   -1.7619929172  -0.9415626151  -2.6299807006
H   -3.4749366035   0.3445838259   1.8135398809
H   -4.1841829769  -0.7213919399  -2.2777836611
*