! 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   0.1173441904   0.4267831205  -1.8745590204
Cl   3.6983576232   2.7372293769   1.2947961160
O   -2.1146367988  -0.4110351071  -0.1977661307
O   -1.9377777591  -0.6735482676   2.0024829425
N    0.0120036698  -2.5256815265  -0.4636408007
N   -0.5103077757  -2.8401380673  -1.6512997707
N    1.7288170040  -2.7490002495  -1.7767232439
C   -1.2157255188  -0.7655053059   0.8054862352
C   -3.0753184481   0.4974513149   0.3504459565
C   -2.7845819105   0.4531653815   1.8542919808
C   -0.8076557717  -2.2382578325   0.6821965074
C    0.0120354257   0.1504442106   0.8562512773
C   -2.9660921606   1.8889689719  -0.2405309545
C   -3.3346971998   1.9558470341  -1.7129071047
C    0.6498026497   0.7031386213  -0.2538887986
C    0.5792869184   0.4087923789   2.1034178577
C    1.7796150421   1.5006349581  -0.1236132803
C    1.7055602889   1.1958051086   2.2611617311
C    1.3421992564  -2.4674881596  -0.5581283380
C    2.2950470506   1.7430608092   1.1353600481
C    0.5537154679  -2.9611120472  -2.3993839615
H   -4.0657725202   0.0859092306   0.1336782887
H   -2.2856887927   1.3674106023   2.1962528871
H   -3.6774757408   0.3014394151   2.4582589873
H   -1.7015701931  -2.8584424881   0.6302138399
H   -0.2528826795  -2.5244374582   1.5753763390
H   -3.6363312860   2.5370328970   0.3320904087
H   -1.9556832709   2.2756260352  -0.0785864401
H   -4.3636251363   1.6311256247  -1.8774187056
H   -3.2486858615   2.9754656461  -2.0886112273
H   -2.6851684268   1.3270791597  -2.3206403096
H    0.1275721688  -0.0140640371   2.9897151676
H    2.2491752390   1.9213763752  -1.0015849009
H    2.1094532585   1.3765256757   3.2471182694
H    1.9818598600  -2.2441987263   0.2814833399
H    0.4816708310  -3.2249606175  -3.4426468591
*