! 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   0.7551554120  -0.1728368367   2.1359099293
Cl   4.3091610371  -1.8993425162  -1.4151225892
O   -2.1633310366  -0.4638053655  -1.2834822371
O   -1.8530760070  -0.2273387025   0.9018270016
N   -0.4323473668   2.3392022241   0.2949708369
N   -0.7828656391   2.7511962196   1.5155866157
N    1.3674670261   3.2479772988   1.1057121364
C   -1.3016618722   0.0951843998  -0.3308494557
C   -2.8012156460  -1.6066056967  -0.7041903260
C   -2.3454771866  -1.5480593735   0.7598266582
C   -1.3380436198   1.6102294307  -0.5524646777
C    0.1155105154  -0.4563833871  -0.5203919919
C   -4.3019691218  -1.5206466888  -0.9152470569
C   -4.9678804130  -0.2994993760  -0.3001224027
C    1.0724042776  -0.5798910589   0.4860795960
C    0.5129259689  -0.7883563373  -1.8148766202
C    2.3591549905  -1.0298544914   0.2171463099
C    1.7894317833  -1.2299682531  -2.1116505319
C    0.8496362303   2.6341046521   0.0712646415
C    2.7058448781  -1.3496069415  -1.0814710729
C    0.3244313266   3.2851718792   1.9563463240
H   -2.4205188591  -2.5121979645  -1.1849819624
H   -3.1534407704  -1.6985537736   1.4752262046
H   -1.5642312336  -2.2865858258   0.9679295869
H   -2.3470274122   1.9795225352  -0.3735988134
H   -1.0820736392   1.8228659017  -1.5895025395
H   -4.7389136138  -2.4327734989  -0.5003044281
H   -4.5067763441  -1.5528170305  -1.9885528567
H   -4.5659977286   0.6305335342  -0.7025392648
H   -6.0369580085  -0.3065620543  -0.5123150552
H   -4.8583156662  -0.2699840350   0.7849464033
H   -0.1943965444  -0.6993763066  -2.6273359968
H    3.0785618493  -1.1211443942   1.0186649912
H    2.0576675258  -1.4746962786  -3.1295598161
H    1.3522047326   2.4101090552  -0.8569106444
H    0.3833648024   3.7314513985   2.9365299822
*