! 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   0.5261240427  -1.3021566485   2.3492314035
Cl   1.5666148204  -5.3862656788  -0.9089487171
O   -0.8012755345   0.6728634064   0.6286640505
O   -0.0788206790   1.0391857278  -1.4669598269
N    1.2840290640   2.6205242703   0.4225077580
N    0.8421504218   3.1167755360   1.5816250189
N    0.8328783648   4.7033838680  -0.0067272724
C    0.2798731791   0.4795598950  -0.2344531303
C   -1.7929050496   1.4823159714  -0.0007809800
C   -1.4791039143   1.2573656428  -1.4710148802
C   -3.1676895052   1.0424064371   0.4696871289
C    1.5410262759   1.2172648148   0.2421465353
C    0.5830076474  -1.0083016085  -0.3701058301
C   -4.2721565855   2.0607961208   0.2044356651
C    0.7080366641  -1.8649584171   0.7228274611
C    0.7922599984  -1.5525785942  -1.6333254488
C   -4.5222127537   2.3829768155  -1.2619831207
C    1.0054124939  -3.2105256958   0.5665730447
C    1.0933301032  -2.8914479679  -1.8182978301
C    1.2586271466   3.5724474554  -0.5126555695
C    1.1928697638  -3.7118114149  -0.7093358009
C    0.5897152063   4.3615604382   1.2734445726
H   -1.6358423273   2.5357298144   0.2712971314
H   -2.0129917271   0.3862231634  -1.8684350837
H   -1.6865530336   2.1166854059  -2.1055607400
H   -3.1155646717   0.8721606794   1.5475659796
H   -3.4210003047   0.0808911588   0.0120406713
H    2.3300637629   1.0966380133  -0.4998151876
H    1.9083958743   0.8120241682   1.1817831629
H   -4.0468812347   2.9839038007   0.7460155241
H   -5.1935640972   1.6725653678   0.6437235033
H    0.7204596320  -0.9187009102  -2.5051521342
H   -3.6916704238   2.9257584121  -1.7150767728
H   -4.6907242501   1.4784983846  -1.8497242156
H   -5.4049785087   3.0137284515  -1.3730273982
H    1.0908052070  -3.8537816263   1.4312038497
H    1.2480836568  -3.2806602281  -2.8146211377
H    1.5775862274   3.4072758240  -1.5289622470
H    0.2227026363   5.0600491583   2.0088697306
*