! 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   2.1604203371  -0.8526395891  -1.8288184600
Cl   0.0759384471  -5.3166495868   0.1962965850
O   -0.8676380102   1.2523855964   0.7856605564
O    0.1764229162   1.2129079755  -1.2062497730
N    1.5783373293   2.6395215528   0.8646102828
N    2.1912115141   3.3304812289  -0.1013970953
N    1.1508322589   4.7215518168   1.3213259777
C    0.2351179483   0.7258758279   0.1048597980
C   -1.7786496559   1.8331749170  -0.1477058855
C   -0.8508008516   2.1856681513  -1.2985260367
C   -2.9065289307   0.8878362119  -0.5245583050
C    1.4960248695   1.2036599413   0.8430939893
C    0.2118926819  -0.7991317962   0.0935564107
C   -3.8201359401   0.5299814855   0.6400333227
C    1.0275041053  -1.5702254513  -0.7333263922
C   -0.6244755447  -1.4792095273   0.9729088871
C   -4.8997102418  -0.4636155967   0.2407430337
C    0.9902449121  -2.9567400566  -0.7103430263
C   -0.6813163479  -2.8615616439   1.0190998463
C    0.9545370646   3.4802688835   1.6917772086
C    0.1278742669  -3.5902787797   0.1663178897
C    1.9090279474   4.5657248935   0.2191117199
H   -2.1886452304   2.7308546806   0.3210982005
H   -1.3282585881   2.1010006496  -2.2751960496
H   -0.4462762127   3.1986732179  -1.2022672052
H   -2.4996337372  -0.0201351056  -0.9830338436
H   -3.4994375788   1.3811659256  -1.3009897946
H    2.3986799471   0.8169905425   0.3761238920
H    1.4723519879   0.8374956277   1.8693018090
H   -4.2832935864   1.4434590832   1.0245413032
H   -3.2391624176   0.1138306243   1.4663422040
H   -1.2546947086  -0.9201751850   1.6485396102
H   -4.4635876038  -1.4087760041  -0.0881611005
H   -5.5674902500  -0.6826078550   1.0745467869
H   -5.5111785572  -0.0814215310  -0.5787894592
H    1.6291108634  -3.5295174085  -1.3676812477
H   -1.3488987295  -3.3539312113   1.7118453122
H    0.3968570116   3.1517003110   2.5537666171
H    2.2747360186   5.3957352717  -0.3647401982
*