! 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   5.1016417793   3.4800159268  -0.9689870139
O   -2.0193292589  -0.9815240475   1.6155403441
N   -0.7938081511  -2.8381275044  -0.3773811144
N   -0.5635094991  -3.3711099374   0.8271898201
N    1.1087566375  -3.8707631876  -0.5767029884
C   -1.9182299387  -0.6926071294   0.2369647157
C   -3.1266916408   0.1913060312  -0.1910740360
C   -0.6814682373   0.2016399158  -0.0414598749
C   -2.6149136098   1.6525060801  -0.1526383736
C   -1.1709642417   1.5962595628   0.3333310862
C   -4.4385504631   0.0087589138   0.5901755711
C   -1.9285468016  -1.9729358761  -0.6123935912
C    0.6110138159  -0.1709007982   0.6943434986
C   -5.5298076156   0.8775098199  -0.0364372212
C   -4.9467353134  -1.4290118386   0.6518794061
C    1.7465291546   0.7317759249   0.3024789700
C    0.2132104636  -3.1344022241  -1.1951031955
C    2.4359836174   0.5160491908  -0.8885789459
C    2.1228693730   1.8134718818   1.0927883997
C    3.4667864777   1.3525414414  -1.2886918718
C    3.1508555957   2.6637932532   0.7109022744
C    0.5873553829  -3.9769454932   0.6564563852
C    3.8139141384   2.4250697186  -0.4816486737
H   -3.3477928471  -0.0631500840  -1.2351632925
H   -0.4922161820   0.1759043693  -1.1227932487
H   -3.2224237116   2.2809638517   0.5018471484
H   -2.6692010320   2.0991657230  -1.1474673544
H   -0.5533932665   2.3872720508  -0.0925111504
H   -1.1302052143   1.7130595620   1.4206139989
H   -4.2770608814   0.3602645800   1.6154942320
H   -1.9096260210  -1.7114788188  -1.6690813281
H   -2.8367875795  -2.5487819398  -0.4368320323
H    0.9147988290  -1.1977141226   0.4911290641
H    0.4475540104  -0.1013323080   1.7715352549
H   -1.4348042542  -1.7248158173   1.8209461809
H   -5.7435780427   0.5554605475  -1.0592159430
H   -6.4595065844   0.7996743455   0.5307416261
H   -5.2636938701   1.9343080029  -0.0736710051
H   -5.0929663733  -1.8425779523  -0.3495323835
H   -5.9158559919  -1.4637449370   1.1544418967
H   -4.2795418432  -2.0910230931   1.2002002188
H    0.2490528061  -2.8084717554  -2.2223420425
H    2.1713020414  -0.3254092669  -1.5194345662
H    1.6086175556   2.0019697610   2.0272677162
H    3.9925736796   1.1663783608  -2.2152777235
H    3.4283494370   3.4993385171   1.3393434507
H    1.0617341251  -4.5224545913   1.4567417196
*