! 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   4.8176302369   4.4830311472  -1.1746471534
O   -1.2760157651  -0.7821627210   1.8488319240
N   -1.8412412050  -3.1605158277   0.1452710408
N   -2.0461472944  -3.5129793198   1.4177413016
N   -3.2409543393  -4.8207488855   0.0486824113
C   -1.3711043362  -0.6950971762   0.4387308796
C   -2.8021873644  -0.1843628120   0.0200794025
C   -0.2914624223   0.3150766968   0.0043665126
C   -0.9813193457  -2.0476817789  -0.1927952273
C   -3.9339711862  -0.9660679824   0.7041674058
C   -2.9772144208   1.2818762813   0.4416743477
C   -3.0142914578  -0.2748826399  -1.4937389296
C    1.1588572357  -0.0557031425   0.3372301338
C    2.0887538029   1.0673129928  -0.0273863867
C   -2.5580892903  -3.9447314736  -0.6545983889
C    2.1808643071   2.2081877821   0.7673901254
C    2.8568147938   1.0112967377  -1.1862560217
C   -2.8930987460  -4.5069502445   1.3076903324
C    3.0137805500   3.2615941526   0.4235931682
C    3.6986060398   2.0536606069  -1.5479334024
C    3.7682899947   3.1733406774  -0.7362995888
H   -0.5031365687   1.2691046156   0.4911199934
H   -0.3710325505   0.4972756246  -1.0705470031
H   -0.9539008736  -1.9762028440  -1.2781587259
H    0.0221395571  -2.3189201840   0.1323674840
H   -4.8846062203  -0.4827718907   0.4731570261
H   -3.8452704497  -0.9725421918   1.7899018721
H   -4.0324656053  -1.9935532392   0.3610422316
H   -4.0179399578   1.5799351158   0.3057043707
H   -2.3748193860   1.9695088476  -0.1520329012
H   -2.7313718555   1.4371921421   1.4931792258
H   -2.2357003006   0.2374970941  -2.0604021539
H   -3.0646466976  -1.3041396483  -1.8523680627
H   -3.9633660413   0.1934968773  -1.7614898544
H    1.4750154238  -0.9503188535  -0.2016390970
H    1.2499135113  -0.2772095739   1.4026127543
H   -1.6783906685  -1.6132704709   2.1383661334
H   -2.5478856933  -3.8561675061  -1.7292282825
H    1.5968415406   2.2803337544   1.6771234509
H    2.8051398090   0.1359121757  -1.8221593713
H   -3.2698206639  -5.0267723194   2.1743682700
H    3.0748278394   4.1370581107   1.0555786566
H    4.2910724338   1.9869153079  -2.4502741881
*