! 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   1.8394128104  -0.2422440675   2.1145138417
Cl   3.8239476425  -3.6691821011  -1.4482530668
O   -1.4645819853   0.3320031957  -0.9125387231
O   -0.9711087771   0.0920344716   1.2696520517
N   -0.7832897265   2.7617579896   0.4584269857
N   -1.7085220670   3.3217340970  -0.3261217410
N   -2.0663212630   3.8658503636   1.8225803688
C   -0.4213222037   0.3790808464   0.0082597761
C   -2.5631915173  -0.3666451556  -0.3339998018
C   -2.3768165170  -0.0532625148   1.1376571979
C    0.1667785452   1.7983661254  -0.0295540640
C    0.6611594144  -0.6428640309  -0.3233055464
C   -3.8630698178   0.1223106014  -0.9284952036
C   -4.0042028527  -0.1887901552  -2.4099869222
C    1.6953892259  -0.9740282940   0.5507742354
C    0.6508757404  -1.2730168974  -1.5633894259
C    2.6697474281  -1.9011152348   0.2149184141
C    1.6097121495  -2.2041666232  -1.9254497839
C   -1.0208077996   3.0821361370   1.7313966253
C    2.6137397282  -2.5113263977  -1.0256209676
C   -2.4454431941   3.9726520785   0.5341517519
H   -2.4517882304  -1.4449039287  -0.5105777843
H   -2.8953287847   0.8691229481   1.4248322232
H   -2.7161639161  -0.8573560044   1.7900016740
H    0.4463787603   2.0579347157  -1.0490740918
H    1.0644658953   1.8674851649   0.5812936766
H   -3.9540109437   1.1974104818  -0.7530330125
H   -4.6753960730  -0.3551830521  -0.3748203356
H   -4.9734770567   0.1399816224  -2.7836002450
H   -3.2394240403   0.3112060199  -3.0037449394
H   -3.9256420702  -1.2600595918  -2.5994192255
H   -0.1276802902  -1.0368869122  -2.2741794925
H    3.4584125990  -2.1406068211   0.9140038014
H    1.5668208272  -2.6777608993  -2.8958618143
H   -0.4016181420   2.7450074782   2.5470089648
H   -3.2929646596   4.5604460801   0.2187294054
*
