! 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  -4.1483957115  -0.7058030683  -0.0791934894
O    1.4517377542   0.9829972433  -0.2686300397
O    3.4189607898  -1.9444968108   0.0705744355
O    2.3034308998  -0.7752861027   1.6199315453
C    2.5000785738   0.1089789980  -0.6144517039
C    0.1776324670   0.5213858838  -0.2439501529
C   -0.7850791288   1.4434636855   0.1904200337
C   -0.1967708612  -0.7590376450  -0.6300904729
C    3.7578487963   0.9462190507  -0.7808150423
C   -2.1118743459   1.0430678182   0.2330638467
C   -0.3870152485   2.8286061148   0.5979532254
C   -1.5308915563  -1.1438015278  -0.5828729929
C   -2.4789114895  -0.2397698458  -0.1494231686
C    2.7056563195  -0.9122276757   0.4929110245
H    2.2919184219  -0.4062237627  -1.5582275214
H    4.0238806636   1.4569676790   0.1444569320
H    3.6045274201   1.6904043701  -1.5609397471
H    4.5944401474   0.3182890163  -1.0810414410
H    0.5221360005  -1.4869071955  -0.9806668983
H   -2.8639971547   1.7446685224   0.5703731921
H    0.3320395426   2.8187675238   1.4182047937
H    0.0744107563   3.3748570784  -0.2262176532
H   -1.2554908973   3.3974934185   0.9254162460
H   -1.8088697531  -2.1437016885  -0.8858432684
H    3.5919037654  -2.5582662732   0.8019508932
*
