! 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   3.1575264057   1.7880679576  -0.4796439736
Cl   2.4444416113   1.3503637825   2.2776172817
Cl   5.0871453908   0.7052445594   1.3624006041
Cl  -3.0631616102   1.2211044129  -2.1170353818
Cl  -5.1299112445   0.2390738692  -0.3883383655
Cl  -2.8422581916   1.5697300521   0.7263023392
O    4.8854037606  -2.7638046898   0.8753858795
O   -4.3911231308  -3.2083316726  -0.3376443714
N    1.4930914950  -0.7170956865   0.3151710938
N   -1.2615482034  -0.9486884863  -0.2066526902
N    3.7242719874  -1.2966809295  -0.4291752693
N   -3.0973340717  -1.7389669965  -1.5052697011
C   -0.7614843616  -0.9078303741   1.1580379394
C    0.6445307109  -1.4714490118   1.2156609023
C   -0.3889979108  -0.2772100431  -1.1516443596
C    1.0245928586  -0.8236562897  -1.0503171425
C    2.8924809602  -0.7257862278   0.5931495181
C   -2.6730071525  -0.9252347358  -0.3954691418
C    3.3742558486   0.7202559856   0.9171490211
C   -3.3744908714   0.4663361249  -0.5419062978
C    4.6643836755  -2.2326845724  -0.1967818873
C   -3.9115869184  -2.8010937747  -1.3805011051
H   -1.4148005768  -1.5065025881   1.7947168977
H   -0.7306297614   0.1050979291   1.5729055602
H   -0.7324364205  -0.4496249297  -2.1721435721
H   -0.3536956406   0.8079175766  -0.9929882123
H    0.6374769823  -2.5439864230   0.9715002396
H    1.0078592633  -1.3725558916   2.2385314719
H    1.6425184308  -0.2381006905  -1.7299268409
H    1.0391802187  -1.8632075819  -1.4077186216
H    3.0786879403  -1.2953533849   1.5058584247
H   -3.1174770124  -1.3561395393   0.5030444730
H    3.6860516292  -0.9183365544  -1.3637830884
H   -2.7692988511  -1.5190456005  -2.4335966207
H    5.2212687111  -2.4811762097  -1.1090041511
H   -4.1041436997  -3.2811479170  -2.3481856611
*