! 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   3.9221809068   3.8771919622   0.4574890037
O   -0.7651656304  -0.2882620081   1.2191615070
N   -1.4130312723  -2.9244055415   0.2978822038
N   -1.3199324164  -3.6268857896  -0.8348733275
N    0.2002289079  -4.3398686160   0.6526903359
C   -1.6946049330  -0.4503914606   0.1646814623
C   -2.7887588397   0.6701279541   0.2405145720
C   -1.0045075415  -0.4600808870  -1.2241620520
C   -2.3329796211  -1.8179461307   0.4467076058
C   -3.7416876487   0.6085130532  -0.9568847389
C   -3.6196916524   0.5495482083   1.5229296617
C   -2.1146860005   2.0482270336   0.2557714022
C    0.4956025210  -0.7822669804  -1.2505015957
C    1.3709671121   0.3676790447  -0.8220886860
C   -0.4978206674  -3.3534014352   1.1655287714
C    1.3735814961   1.5593697798  -1.5469924865
C    2.1945746985   0.2850680738   0.2977299982
C   -0.3437364923  -4.4576151298  -0.5720117796
C    2.1559654842   2.6376216317  -1.1668995987
C    2.9854526757   1.3544294521   0.6966789205
C    2.9539293915   2.5266269165  -0.0387950680
H   -1.1366091365   0.5038226723  -1.7178325764
H   -1.5237684338  -1.1700762330  -1.8698216802
H   -2.7145653173  -1.8546774482   1.4658625149
H   -3.1683874529  -2.0063851154  -0.2231127154
H   -3.2425145199   0.8080287755  -1.9051886888
H   -4.5215190293   1.3639294366  -0.8436184464
H   -4.2473545931  -0.3545965490  -1.0442699683
H   -2.9932689099   0.4882387888   2.4136667109
H   -4.2837938648  -0.3163384147   1.5154613688
H   -4.2562696905   1.4294509976   1.6329482979
H   -1.5405445680   2.2218717088   1.1680827555
H   -1.4501939667   2.2121016467  -0.5951112910
H   -2.8753123409   2.8295829806   0.2160240674
H    0.7484679302  -1.0382795367  -2.2823745463
H    0.7377986019  -1.6632445544  -0.6563935361
H   -0.2395343643   0.5039211190   1.0683907364
H   -0.3867806967  -2.9431449295   2.1558012166
H    0.7533936849   1.6562235324  -2.4302474742
H    2.2232239078  -0.6283660801   0.8789560511
H   -0.0167824296  -5.1879397435  -1.2955209531
H    2.1397510713   3.5514750674  -1.7449432828
H    3.6120836321   1.2685641728   1.5739864160
*