! 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  -0.7623627637  -1.9409255217  -2.2310518197
Cl  -4.4354268697  -2.0969573393   1.6623057943
O    3.1497526620  -0.3438952189  -0.0291727176
N    1.9586814796  -0.8392546855   0.3981555460
N    3.0447623384   3.7462080924  -0.5829058937
C    1.0705179621   0.6348034231  -1.3714769787
C    0.9698584573  -0.3841004233  -0.2646623223
C   -0.3595047202  -0.8323006995   0.2025003752
C    1.4266079938   1.9871779479  -0.8109467017
C   -1.2460397422  -1.5160390542  -0.6258310888
C   -0.7678798397  -0.5663216210   1.5067388899
C    0.5288543112   2.7104284416  -0.0343392712
C    2.6705094376   2.5602587186  -1.0468226658
C   -2.5004030242  -1.9104932829  -0.1928931431
C   -2.0154667893  -0.9494882525   1.9693786686
C   -2.8721285881  -1.6147053124   1.1086156480
C    0.9080344500   3.9469099399   0.4622696745
C    2.1741693130   4.4206147890   0.1606072094
C    4.2054102028  -0.8249555282   0.7830496230
H    1.8147399143   0.3267653373  -2.1079459121
H    0.1173476435   0.7041697030  -1.8943820589
H   -0.0991785048  -0.0368242026   2.1717360440
H   -0.4597496774   2.3198767230   0.1766668079
H    3.3980213643   2.0310422646  -1.6521080330
H   -3.1671653263  -2.4467431655  -0.8535422753
H   -2.3108859803  -0.7269438273   2.9848363907
H    0.2337561297   4.5370485870   1.0670885084
H    2.4978923060   5.3858610392   0.5312058820
H    5.1178678159  -0.3896823952   0.3811648505
H    4.2851867565  -1.9131234890   0.7439097329
H    4.0917446989  -0.5099832191   1.8221439873
*