! 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   1.5530843913   2.1655644635   1.1538639779
Cl   5.5628486861  -1.0910743279  -0.1493263259
O   -1.0818255905  -1.0064692716  -0.6838903446
O   -0.8342263097   0.4459117955   1.0170290980
N   -1.9684461467   1.7103877000  -1.2024710900
N   -2.9676248675   1.1429451988  -1.8846304470
N   -3.7643576279   2.6856860218  -0.4603835732
C   -0.3590658235   0.1094720164  -0.2600948232
C   -1.7857531713  -1.5676547776   0.4222722675
C   -1.9666887358  -0.3552610605   1.3159728160
C   -3.0755091350  -2.1924189093  -0.0673224159
C   -0.6117297494   1.2380464402  -1.2741293870
C    1.1351451625  -0.1823498428  -0.1897198962
C   -3.9763897003  -2.6883004696   1.0605617520
C    2.0507200967   0.6825939224   0.4085333657
C    1.6415509337  -1.3367475040  -0.7770580660
C   -3.3719129336  -3.8004593973   1.9049114128
C    3.4103200475   0.4122478449   0.4273624579
C    2.9941937908  -1.6349031507  -0.7696484749
C   -2.4606542138   2.6125538721  -0.3527246454
C    3.8691040989  -0.7511652358  -0.1647044403
C   -4.0155002705   1.7619183483  -1.4079416319
H   -1.1501539609  -2.3129474121   0.9157880047
H   -2.8990515542   0.1790040267   1.0950659751
H   -1.9539107418  -0.5960116705   2.3788676646
H   -2.8415173723  -3.0245603683  -0.7371725284
H   -3.6135837041  -1.4472356536  -0.6599175592
H   -0.4131341998   0.8789224552  -2.2825387321
H    0.0497571142   2.0832380722  -1.0959423605
H   -4.9061196940  -3.0453357380   0.6127931688
H   -4.2630658556  -1.8516995182   1.7049874537
H    0.9694135153  -2.0309566516  -1.2600680970
H   -3.0738026750  -4.6494203554   1.2866729761
H   -2.4911796243  -3.4714011623   2.4583782146
H   -4.0919914895  -4.1653032452   2.6378451431
H    4.0971377849   1.1016176143   0.8979960162
H    3.3514451343  -2.5425590570  -1.2347484962
H   -1.8385409473   3.1998884161   0.3036613231
H   -5.0089457742   1.5437131761  -1.7670027690
*