! 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  -0.3536125904  -0.4945088574   2.7199591391
Cl   2.0887278191  -4.1332449511  -0.3062610187
O   -1.7635151243   1.2988199407   0.8391284551
O   -0.8314117143   1.7424995904  -1.1605950153
N    1.7209795898   2.2006945729   0.2688411258
N    2.6754426420   1.4397598103   0.8136146871
N    3.3593447831   2.2636587825  -1.1580737452
C   -0.5549702973   1.2844653207   0.1371082051
C   -2.8342619903   1.3571287046  -0.1005474331
C   -2.1904066647   2.1536484154  -1.2220764825
C   -3.3244693762  -0.0258141569  -0.5035334381
C    0.3992361975   2.2681213518   0.8366760664
C    0.0653001278  -0.1058524545   0.0437957880
C   -4.6287103451   0.0291865228  -1.2903516096
C    0.2026835096  -0.9482586297   1.1439310459
C    0.5902085482  -0.5500066848  -1.1665149853
C   -5.1307280273  -1.3556433839  -1.6683123639
C    0.8134794185  -2.1891610317   1.0447602084
C    1.2151541812  -1.7786342547  -1.2924272347
C    2.1385650570   2.6703292059  -0.9082768117
C    1.3167918513  -2.5920046688  -0.1788281603
C    3.6318231023   1.5137851522  -0.0734547107
H   -3.6457615981   1.9141884203   0.3729197962
H   -2.5809763724   1.9218806651  -2.2130341962
H   -2.2800918077   3.2313024667  -1.0556447461
H   -3.4738498724  -0.6176330953   0.4039431996
H   -2.5619934338  -0.5447775170  -1.0938468096
H    0.4812371939   2.0481442343   1.8980848310
H    0.0120116995   3.2820942211   0.7338146908
H   -4.4950654838   0.6247807501  -2.1980876348
H   -5.3891824922   0.5451956582  -0.6968525926
H    0.5148993161   0.0743306341  -2.0445784651
H   -5.3127980094  -1.9657712082  -0.7818679705
H   -6.0647886830  -1.3013275392  -2.2282727473
H   -4.4051516281  -1.8850442004  -2.2884265536
H    0.8980941335  -2.8261188088   1.9139015566
H    1.6119787351  -2.0900583822  -2.2483038086
H    1.5395051446   3.3123779359  -1.5334079018
H    4.5741879192   1.0098156290   0.0727973280
*