! 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  -4.9669456101  -1.2717619429  -0.1532262954
O    1.6097398255  -0.9187470385  -1.1991204623
N    2.8142086755  -0.2903881482  -0.8259761278
N    0.1986301007   3.1638689026   1.2958575995
C    2.4898124847   0.2702682914   0.4907968864
C    1.6765764441  -0.8619148953   1.1499961534
C    1.0408827972  -1.5690306111  -0.0554063313
C    1.6462217391   1.5222939857   0.2929159499
C    3.7324419559   0.6429761968   1.2905138424
C   -0.4583617855  -1.4753200539  -0.1255751094
C    3.8846060075  -1.2755245041  -0.8332474119
C    1.5723820869   2.2031934200  -0.9151690121
C    0.9385446755   2.0646383557   1.3620036875
C   -1.2218267054  -2.5249639974   0.3745903920
C   -1.1147467112  -0.3616690663  -0.6426759411
C    0.7960347317   3.3485852770  -1.0030642899
C   -2.6073408141  -2.4711917473   0.3780845179
C   -2.4997839693  -0.2948231393  -0.6534203256
C    0.1265856877   3.7879775359   0.1249402668
C   -3.2356512301  -1.3508474448  -0.1399290053
H    2.3408287788  -1.5410764068   1.6856923154
H    0.9386071955  -0.5093949523   1.8673012649
H    1.3199632118  -2.6286436804  -0.0538088489
H    3.4377226897   1.0947561456   2.2372688490
H    4.3458626347   1.3701897456   0.7574370275
H    4.3459450408  -0.2260519314   1.5258687647
H    4.8350282456  -0.7690248973  -0.6782708880
H    3.9247072887  -1.7347594774  -1.8192484153
H    3.7951752340  -2.0714855378  -0.0854689161
H    2.1054382843   1.8424611749  -1.7828657755
H    0.9728988004   1.5888722909   2.3364647654
H   -0.7327288885  -3.4071945701   0.7692286116
H   -0.5561918784   0.4710597206  -1.0464766697
H    0.7113988988   3.8920878376  -1.9339367868
H   -3.1832806409  -3.2976797005   0.7709663859
H   -2.9961489101   0.5747152861  -1.0623135452
H   -0.4887666703   4.6788968115   0.0862039551
*