! 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  -4.2292346946  -0.1347525358  -0.5453244924
O    1.3205970914  -0.2714152260   1.3060920739
O    2.9693780901   1.8900685244  -0.8771180110
O    1.5494032812   0.4486682043  -1.8139980412
C    2.7523125281  -1.6421296515  -0.1451555306
C    2.1519970234  -1.4236509998   1.2312067320
C    3.4781635892  -0.4096243968  -0.6678079737
C    0.0503037433  -0.3123329790   0.8509389921
C   -0.6669332823   0.8883496343   0.9640143777
C   -0.5545275169  -1.4406921681   0.3116724590
C   -1.9829475218   0.9195887567   0.5289753227
C   -0.0264089857   2.1085802950   1.5518823265
C   -1.8744385844  -1.3936891762  -0.1189968158
C    2.5497862534   0.6593784208  -1.1690522843
C   -2.5795477347  -0.2124734117  -0.0081678435
H    2.0050133758  -1.9765607403  -0.8667102032
H    3.4688813170  -2.4597863449  -0.0484202633
H    2.9519250176  -1.2322983579   1.9471788074
H    1.6206658151  -2.3149301794   1.5766915266
H    4.1005727935  -0.6911863117  -1.5227983134
H    4.1564434689  -0.0085323769   0.0865442495
H   -0.0208889327  -2.3754533596   0.2110487786
H   -2.5443427359   1.8414554177   0.6126599520
H    0.8772539269   2.3973590708   1.0120412262
H   -0.7115892914   2.9548018726   1.5232202689
H    0.2622613987   1.9526116946   2.5937908447
H   -2.3311922875  -2.2793562131  -0.5386092033
H    2.3694864551   2.5409782667  -1.2722660177
*
