! 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   1.5898293911   1.9875951935   1.8507342231
Cl   4.5250763755  -0.2775551518  -1.9740654199
O   -1.5774346867  -0.9506120974   0.5628668446
O   -0.7069135553   0.1564459824   2.2825464229
N   -1.4696803513   1.5641298681  -0.9914236766
N   -0.5396174078   2.3103006326  -1.5945158051
N   -1.7183245153   1.1488439872  -3.1100120646
C   -0.7834148750   0.1512404659   0.8905952600
C   -1.4379073051  -1.9388099031   1.5885919650
C   -0.6256976166  -1.2058952115   2.6651471942
C   -2.8066176982  -2.3937345700   2.0526774419
C   -1.5067490654   1.4253807902   0.4420561458
C    0.5888560185   0.0285500879   0.2271887329
C   -3.6439384177  -3.0466288410   0.9608575251
C    1.6822019549   0.8165286590   0.5791737313
C    0.7567798481  -0.8500609800  -0.8387640910
C   -4.9944645603  -3.5182794485   1.4773784809
C    2.8960972044   0.7246419257  -0.0842794647
C    1.9541656522  -0.9592277770  -1.5249831041
C   -2.1507784847   0.8699200582  -1.9049010368
C    3.0181387229  -0.1665500472  -1.1356405973
C   -0.7325415815   2.0303534564  -2.8557745577
H   -0.8759618129  -2.7924215229   1.1953220785
H   -1.0460331593  -1.3101235670   3.6651992415
H    0.4137432969  -1.5466728649   2.6895547554
H   -3.3438370642  -1.5429864254   2.4859778693
H   -2.6549276673  -3.1101722223   2.8659783347
H   -1.0418501678   2.3079938758   0.8739684961
H   -2.5427901663   1.3901008826   0.7777698898
H   -3.0939357411  -3.8957680314   0.5442110982
H   -3.7966925880  -2.3449078938   0.1373294372
H   -0.0707549746  -1.4688979406  -1.1547331924
H   -4.8809481688  -4.2382281596   2.2899695212
H   -5.5867357035  -2.6842794844   1.8584774702
H   -5.5755236392  -4.0001828234   0.6903041615
H    3.7290072872   1.3464186082   0.2128159226
H    2.0469067135  -1.6516256383  -2.3496702370
H   -2.9550694118   0.1969563266  -1.6549036303
H   -0.1398516524   2.4895798981  -3.6311310273
*
