! 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   0.3396951396   0.9103441726  -1.8980863452
Cl   4.4506634067  -2.1382896142  -0.4734611407
O   -1.9689990298   0.0478709810  -0.4190302759
O   -1.8686798233  -1.3059723652   1.3381466413
N   -0.4429986946   2.0481600081   1.1556307649
N   -1.0487006928   2.9900417270   0.4283785059
N    1.1508349157   3.4111706555   0.5858506850
C   -1.1897852428  -0.2702282119   0.6845416345
C   -2.6802646611  -1.1182437361  -0.8320773478
C   -2.4111596073  -2.1135384902   0.3052213637
C   -1.1467861091   0.9033627173   1.6683185753
C    0.2242426843  -0.7251142474   0.3056489043
C   -4.1431611148  -0.7751586025  -1.0514138239
C   -4.8582861206  -0.2123039910   0.1673338376
C    0.9567958461  -0.2590860315  -0.7846086297
C    0.8597223231  -1.6313893059   1.1540752416
C    2.2533858950  -0.6943357433  -1.0306296752
C    2.1502766100  -2.0769803003   0.9355884384
C    0.8633807795   2.3089613453   1.2313000405
C    2.8374501303  -1.6015789248  -0.1677446470
C   -0.0553576186   3.7782498226   0.1143993545
H   -2.2549525460  -1.4910517836  -1.7690369956
H   -3.3090964235  -2.6032412386   0.6810251864
H   -1.7017368591  -2.8886158828   0.0000615685
H   -0.6540478674   0.5842117725   2.5862618099
H   -2.1629244147   1.2055206640   1.9185626204
H   -4.6419010784  -1.6868584729  -1.3906330469
H   -4.2166934455  -0.0678236561  -1.8814767199
H   -4.8652189854  -0.9101553867   1.0062076685
H   -4.4061938958   0.7185861752   0.5097001449
H   -5.8993325616   0.0034271178  -0.0735269020
H    0.3316190303  -2.0083482387   2.0188699919
H    2.7964246397  -0.3196915316  -1.8869175041
H    2.6053480227  -2.7822616944   1.6162423589
H    1.5546598508   1.6902496251   1.7819476461
H   -0.2091007459   4.6668321783  -0.4773608609
*