! 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   0.6667584386   1.0535745615   1.9430346583
Cl   5.2529867935  -1.0395871530   0.1971696717
O   -1.1704218951   1.0099542756  -0.4188277998
N   -2.8774837009  -1.1427305352   0.1074525697
N   -4.9375492132  -0.3557521018   0.1284827877
C   -0.6805033452  -0.2876028534  -0.5839254531
C   -1.4578589503  -1.2022953482   0.3601477705
C    0.8089767790  -0.4261271414  -0.3464116912
C    1.4890366917   0.1177453393   0.7407931018
C    1.5555993019  -1.1668898404  -1.2574037414
C   -3.5557460057  -1.8068244048  -0.8784907874
C   -3.7469901770  -0.2738721663   0.6637206008
C   -0.6662095089   1.9430146089  -1.3367511248
C    2.8529348777  -0.0642111477   0.9153205632
C    2.9159874026  -1.3736967542  -1.1081708885
C    3.5529117632  -0.8130282325  -0.0148511029
C   -4.8257673412  -1.3137034911  -0.8425467952
C   -1.3739622939   3.2463243382  -1.2037602554
C   -2.3514306148   3.5262608210  -0.3517567456
H   -0.8691814516  -0.6310795537  -1.6127407866
H   -1.1185549029  -2.2286720179   0.2275116936
H   -1.2830485642  -0.9325192579   1.4010748312
H    1.0543705231  -1.5942201350  -2.1167823527
H   -3.0907566315  -2.5617255677  -1.4904776023
H   -3.4636013284   0.3809972818   1.4723374371
H    0.4109475252   2.1111011036  -1.1919300335
H   -0.7743476247   1.5781737423  -2.3695065595
H    3.3573982607   0.3715236543   1.7662404468
H    3.4639085877  -1.9545915557  -1.8362841554
H   -5.6630118701  -1.6036253734  -1.4573924909
H   -1.0192647329   4.0114162224  -1.8868503246
H   -2.8007352131   4.5104460606  -0.3330168239
H   -2.7425520343   2.8006761305   0.3493908235
*
