! 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   4.8534821570  -0.5533980249  -1.3702240067
O   -0.2167082948  -0.1480629065   1.5467122017
O   -1.2207351002  -0.8150787101  -1.1945210256
N   -1.3291835893   1.5953233555   0.3593368007
N   -1.7050468092   2.6332342543   1.1258939006
N   -0.8445388263   3.3616103209  -0.8120091840
C   -2.9674895370  -1.6921846992   0.2010959228
C   -1.8266327651  -0.7643030928  -0.1519480050
C   -1.4059344678   0.2679440934   0.9071003149
C   -3.1809786669  -2.7061035050  -0.9169823397
C   -2.6461343526  -2.4246339373   1.5106683607
C   -4.2334295895  -0.8396089623   0.3733473712
C    0.9518425980  -0.2292741621   0.8237435703
C   -0.8004036832   2.0562073490  -0.7877197985
C    1.3804399610  -1.4635495367   0.3562860274
C    1.7341460206   0.9024210822   0.6392837624
C   -1.4037000212   3.6577882631   0.3802650223
C    2.5864800121  -1.5673739722  -0.3166010803
C    2.9384437082   0.8048382062  -0.0417682821
C    3.3504346883  -0.4281433718  -0.5199364666
H   -2.1358769006   0.3259921850   1.7095798015
H   -3.4311845410  -2.2262697142  -1.8634100148
H   -2.3018706981  -3.3316821534  -1.0753124300
H   -4.0092848234  -3.3651597571  -0.6548550711
H   -3.4633001904  -3.1083240386   1.7434690768
H   -2.5403964295  -1.7545666180   2.3643910526
H   -1.7346290355  -3.0187151609   1.4295571034
H   -4.1627485961  -0.1269979338   1.1962469795
H   -5.0772730490  -1.4944619062   0.5939048810
H   -4.4716486892  -0.2854121413  -0.5354239905
H   -0.4144174230   1.4273845275  -1.5708870621
H    0.7856888034  -2.3518292927   0.5256032939
H    1.4318626152   1.8582413018   1.0470000991
H   -1.5984557875   4.6676697326   0.7040323115
H    2.9208056953  -2.5298943304  -0.6779114700
H    3.5472066003   1.6864030149  -0.1865550778
*