! 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  -0.2263161090  -1.4283700230   2.0327802755
Cl   1.5298627735  -5.3434248308  -1.1257577835
O   -0.9268366140   0.7270514726   0.1975856662
O    0.3325512850   1.1855425555  -1.6084633167
N    1.1845704963   2.5637417622   0.7095912742
N    0.4723858104   2.9863762579   1.7581819394
N    0.8850158874   4.6877293645   0.3529430898
C    0.3329380091   0.5317336289  -0.3675750103
C   -1.6787111382   1.6307873332  -0.6050200192
C   -1.0116906242   1.4741782203  -1.9577809772
C   -3.1450717480   1.2643945080  -0.5705417238
C    1.4456581356   1.1676681933   0.4803340436
C    0.6086387759  -0.9587595599  -0.5305623562
C   -3.7660425377   1.2786898451   0.8236217196
C    0.3880272315  -1.8914258362   0.4821415780
C    1.1433057392  -1.4301786799  -1.7253244535
C   -3.6988888589   2.6291397455   1.5226249581
C    0.6644973719  -3.2392897668   0.3067882770
C    1.4313939077  -2.7695500223  -1.9267339295
C    1.4081874218   3.5840381434  -0.1216411309
C    1.1825712087  -3.6657724767  -0.9032535155
C    0.3213877434   4.2584725381   1.4992154708
H   -1.5413477930   2.6564639906  -0.2384811282
H   -1.4530044366   0.6555043179  -2.5381838468
H   -1.0312109873   2.3827784065  -2.5576947477
H   -3.2778521783   0.2761638416  -1.0201356965
H   -3.6744605025   1.9740596978  -1.2140498862
H    2.4013676603   1.0651870449  -0.0336867912
H    1.5350391169   0.6748487377   1.4455225415
H   -3.2860484926   0.5181460591   1.4441045325
H   -4.8118175716   0.9762176852   0.7295484504
H    1.3424592993  -0.7375071237  -2.5300602725
H   -2.6727370113   2.9294674147   1.7413874320
H   -4.1503575868   3.4157075076   0.9144159531
H   -4.2345188809   2.6022504843   2.4723741858
H    0.4785215801  -3.9423003981   1.1066825361
H    1.8437176772  -3.1003970440  -2.8693346849
H    1.9713769141   3.4866491707  -1.0355368331
H   -0.2078180159   4.9119583950   2.1748322750
*