! 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 "1-OCTANOL"
end
*xyz 0 1
Cl  -0.1619900487   0.2111369888   2.0312263384
Cl  -4.5312786351  -2.1518385790   0.0593503699
O    3.3501161817  -0.8094059210   0.1060983719
N    2.0635588553  -1.2111226373   0.2889322884
N   -0.0360215456   3.4804464055  -0.6207152225
C    1.6002523753   0.2563669237  -1.6530505545
C    1.2546017241  -0.7145725767  -0.5528976190
C   -0.1721842130  -1.0660538651  -0.3685873715
C    1.4417301828   1.6578775598  -1.1244329175
C   -0.8970854820  -0.7065441919   0.7662039936
C   -0.8463235423  -1.7498285430  -1.3778053362
C    2.5046078542   2.3637117039  -0.5742862457
C    0.1940045737   2.2743067633  -1.1189611523
C   -2.2374078908  -1.0355431269   0.9061474170
C   -2.1806200978  -2.0952861764  -1.2617395415
C   -2.8630900091  -1.7345428813  -0.1111766071
C    2.2767672522   3.6285976588  -0.0571206620
C    0.9893394538   4.1404660566  -0.0971576687
C    4.1768088368  -1.3570107348   1.1145006960
H    2.6146860506   0.0952049265  -2.0155806294
H    0.9252637276   0.1014440867  -2.4961660920
H   -0.3114026075  -2.0304495403  -2.2762989247
H    3.4980414608   1.9339809058  -0.5536570985
H   -0.6616772021   1.7621670563  -1.5494626206
H   -2.7823570196  -0.7444014597   1.7933298147
H   -2.6758567973  -2.6358133065  -2.0562167741
H    3.0813113092   4.2104731245   0.3716492072
H    0.7789998386   5.1254709385   0.3044764559
H    3.8785173514  -1.0206704580   2.1101890986
H    5.1833078595  -0.9975684881   0.9083637322
H    4.1801938338  -2.4490638717   1.0923051079
*