! 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   2.1494051541  -0.5589218763  -2.0926637361
Cl   1.1512669966  -5.4579139935  -0.2571674132
O   -0.8676353078   0.7359276051   1.0080526388
O   -0.0892331228   1.0994498165  -1.0693114799
N    1.2463454715   2.5873703163   0.9263157231
N    0.7621385055   3.0889872737   2.0677492301
N    0.8858334636   4.6883121695   0.4971471076
C    0.2198413091   0.5025570804   0.1565780486
C   -1.8801570370   1.4662159274   0.3175361366
C   -1.4968517496   1.2381042037  -1.1338079626
C   -3.2573274218   0.9647538933   0.6949637770
C    1.4686627296   1.1786191071   0.7421416737
C    0.4538394731  -0.9990847952   0.0149389079
C   -4.3539804013   1.7687926013   0.0042016160
C    1.3020560970  -1.5465777340  -0.9471726082
C   -0.1666169454  -1.8838983339   0.8915308533
C   -5.7488290663   1.2980814434   0.3838968443
C    1.5204500117  -2.9126048891  -1.0395801663
C    0.0335614093  -3.2524582966   0.8225584640
C    1.2988937093   3.5477780688   0.0021489950
C    0.8797259463  -3.7552409599  -0.1485618328
C    0.5681528332   4.3440003935   1.7597258914
H   -1.7927037432   2.5305710557   0.5742800065
H   -1.9674326613   0.3321001761  -1.5365975318
H   -1.7329032718   2.0761154701  -1.7871613861
H   -3.3839413713   1.0360909183   1.7787291145
H   -3.3425239178  -0.0943277090   0.4305879061
H    2.3281883752   1.0426168096   0.0889958286
H    1.7131172884   0.7364972751   1.7056773222
H   -4.2371124322   1.7039316468  -1.0816108588
H   -4.2418534495   2.8260678794   0.2610983049
H   -0.8292557314  -1.5028139128   1.6542345520
H   -5.9124936004   1.3689614031   1.4604373966
H   -6.5148997862   1.8995858015  -0.1061656918
H   -5.9098641871   0.2588827089   0.0926216641
H    2.1825725181  -3.3082186601  -1.7967465684
H   -0.4675406237  -3.9083631595   1.5200280296
H    1.6619480082   3.3814954681  -0.9990346746
H    0.1889461900   5.0468652279   2.4846981425
*