! 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  -0.8850213257  -1.6113736772   2.6294896644
O    3.6700292827   0.7743205924  -0.4113222650
O    2.4795231892   0.9245693007   1.4492742608
O    1.7055036352  -1.7694234123   0.4562072613
N    0.2696350130  -0.1655511772  -0.1919150562
C    1.3654100251   0.6182974246  -0.7176520004
C    2.0439279187   0.1083363390  -1.9866442219
C    3.4491914572   0.6689271225  -1.8317902612
C   -1.0641055463   0.3055268377  -0.3952074825
C    2.5235844658   0.7663732506   0.2601716508
C   -1.5695254300   1.2961706961   0.4506800674
C   -1.8092759035  -0.2064956607  -1.4633117250
C    0.5585226755  -1.3575166001   0.3766192379
C   -2.8640507975   1.7549302615   0.2216330653
C   -3.1015913776   0.2727601176  -1.6516460195
C   -0.7497142822   1.8886090676   1.5552951191
C   -1.2481645608  -1.2359017238  -2.3991043035
C   -0.5863455668  -2.1640954031   0.9531936358
C   -3.6261224451   1.2460663888  -0.8161819892
H    0.9893276061   1.6307942604  -0.8944442551
H    1.5667180976   0.4756758003  -2.8920617903
H    2.0588988416  -0.9797581797  -2.0203007525
H    4.2233293862   0.0280435850  -2.2460307025
H    3.5432624268   1.6650585983  -2.2647570066
H   -3.2764235491   2.5184665500   0.8692279831
H   -3.6981032481  -0.1180915077  -2.4662366365
H   -0.0065897734   2.5877139779   1.1658089304
H   -1.3841665214   2.4459078146   2.2427292934
H   -0.2134029897   1.1347791598   2.1265921646
H   -0.4523293452  -0.8201260474  -3.0185830614
H   -0.8318720833  -2.1051618275  -1.8877783623
H   -2.0222793328  -1.6011253271  -3.0714919836
H   -1.5212741362  -2.0734970697   0.4089976485
H   -0.2954262806  -3.2099136555   0.9938017335
H   -4.6323024697   1.6102310145  -0.9768257057
*