! 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   2.5598676942  -0.7471507999  -1.4374911087
Cl   0.2666240154  -5.4021244277  -0.2431622358
O   -1.1099910920   1.0560054422   0.4728244176
O    0.3979308874   1.2493276418  -1.1628870900
N    1.2038526816   2.5619428590   1.1855596847
N    2.1187151638   3.2888913300   0.5382936567
N    0.6242217408   4.6251216863   1.5468321232
C    0.1632490789   0.6385990198   0.0674600068
C   -1.8258581628   1.5798100700  -0.6491994956
C   -0.8616176209   1.3244140201  -1.8023416532
C   -3.1796575759   0.9299074763  -0.8488861918
C    1.1788096985   1.1255271172   1.1028474198
C    0.2146063854  -0.8866913495  -0.0316033189
C   -4.2486770732   1.2903235531   0.1779443238
C    1.2366121702  -1.5731030533  -0.6860115341
C   -0.7752825494  -1.6526303353   0.5769978014
C   -4.0313991348   0.7209394505   1.5729798586
C    1.2591656398  -2.9580417284  -0.7584842962
C   -0.7758501772  -3.0360980132   0.5258160287
C    0.3172768083   3.3702767533   1.7682505472
C    0.2447700307  -3.6774388896  -0.1524798046
C    1.7329080514   4.5109443519   0.7917508596
H   -1.9548112363   2.6569018816  -0.4899965926
H   -1.0972995660   0.3894441460  -2.3265786557
H   -0.8413693792   2.1326727698  -2.5313574230
H   -3.0581022480  -0.1567424546  -0.9085197296
H   -3.5305442113   1.2498955975  -1.8353907088
H    2.1836851684   0.7863661962   0.8637353947
H    0.9173440426   0.7131681479   2.0770059534
H   -5.2087776887   0.9309317233  -0.2002844751
H   -4.3391030349   2.3792619295   0.2345648175
H   -1.5749036507  -1.1596720426   1.1107447387
H   -3.9036890387  -0.3629489640   1.5422373152
H   -3.1559997402   1.1432285465   2.0640238289
H   -4.8921657292   0.9270738243   2.2103922202
H    2.0594970369  -3.4635798806  -1.2804213020
H   -1.5637387180  -3.5972190721   1.0079196726
H   -0.5116046494   3.0114745114   2.3556285679
H    2.2795581420   5.3621821257   0.4175796861
*