! 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   5.0403107145   2.5879902713  -1.6755853636
O   -2.3900117743  -0.2122600788   1.8288461885
N   -1.3019832249  -2.5720200053   0.4693080108
N   -0.2735697724  -2.8293044289  -0.3433834837
N    0.1460051708  -3.6111271917   1.7166549510
C   -2.3712902409  -0.3124353899   0.4181536140
C   -3.5970765939   0.4459562719  -0.2021191995
C   -1.0403928957   0.3037084779  -0.0645175430
C   -2.4494467327  -1.8058048675   0.0392388214
C   -4.9191133650  -0.2675531935   0.1160154608
C   -3.6869692421   1.8617282489   0.3780984308
C   -3.4746219659   0.5495379096  -1.7253186154
C    0.1199744239   0.2989853355   0.9379525230
C    1.3585407190   0.8658935238   0.3025901671
C   -1.0346873902  -3.0367959883   1.6890794680
C    1.6536250094   2.2231350686   0.3977830895
C    2.2245332350   0.0554568400  -0.4275938624
C    0.5653670499  -3.4485249834   0.4484070265
C    2.7796712569   2.7626343094  -0.2073240104
C    3.3559994127   0.5736541531  -1.0391589867
C    3.6239079237   1.9284534935  -0.9216956056
H   -1.1989443376   1.3437623735  -0.3545313812
H   -0.7274100081  -0.2038194800  -0.9797983269
H   -3.3271570986  -2.2661698493   0.4930578251
H   -2.5336162202  -1.9413500426  -1.0367381031
H   -5.7558684045   0.3507482332  -0.2129799540
H   -5.0695209044  -0.4432291928   1.1846890348
H   -5.0180046923  -1.2258308194  -0.3952677484
H   -2.7941519042   2.4582259969   0.1857155494
H   -3.8586488593   1.8590896438   1.4542458702
H   -4.5244823781   2.3901842283  -0.0804834552
H   -4.3446880009   1.0713761939  -2.1279991213
H   -2.5936142689   1.1100539926  -2.0387793474
H   -3.4389404027  -0.4257752295  -2.2134130650
H    0.3355768884  -0.7027462455   1.3104886558
H   -0.1420428684   0.9032420787   1.8068686192
H   -3.2459153812  -0.5137752444   2.1543711016
H   -1.7236918046  -2.9582949619   2.5141759689
H    0.9983415667   2.8773948435   0.9601701134
H    2.0170343442  -1.0037162672  -0.5206056692
H    1.5158633353  -3.8115929738   0.0901062985
H    2.9941330774   3.8187515270  -0.1163885117
H    4.0194423536  -0.0739115297  -1.5960600185
*