! 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   6.2716213076  -1.3265852985   2.6989768223
N   -3.6112518814   0.9258480726   0.4381469271
N   -3.8315596181   2.1209755566  -0.1179568336
N   -5.5775213847   0.7572144452  -0.4729437826
N   -2.3767009138  -2.4999717049  -0.4246846405
C   -1.3936917647  -0.1147747329   0.0033178443
C   -0.0255949322  -0.3223486344   0.6885304105
C   -2.3363123235   0.5865655665   1.0139136739
C   -1.3053743411   0.7002003126  -1.2789753069
C    1.0061025386  -1.0169050994  -0.1972703846
C    2.3316101407  -1.1140253154   0.5019798829
C   -1.9471069735  -1.4436630926  -0.2655631760
C   -0.5857676218   1.8927702267  -1.2727573518
C   -1.9778772937   0.3279270335  -2.4362870146
C    2.6404233855  -2.2061573685   1.3075690815
C    3.2660192724  -0.0879220713   0.3927375873
C   -0.5316183019   2.6888412408  -2.4047835467
C   -1.9258684055   1.1271264822  -3.5712691752
C   -4.6559570741   0.1252764124   0.2101266175
C   -1.2020530639   2.3086452065  -3.5604056769
C    3.8476954320  -2.2807203079   1.9866389039
C    4.4785507592  -0.1432892576   1.0631365834
C   -5.0166962389   1.9698821853  -0.6444113564
C    4.7579109955  -1.2440307807   1.8572569272
H   -0.1794751930  -0.8988654864   1.6039042920
H    0.3497093638   0.6527472293   1.0044388234
H   -2.4935618434  -0.0475552728   1.8855176386
H   -1.8659337290   1.5068705205   1.3530475829
H    1.1246907869  -0.4634336493  -1.1307477879
H    0.6564012685  -2.0167079867  -0.4659100872
H   -0.0633011360   2.2180022901  -0.3815897496
H   -2.5533529549  -0.5887850168  -2.4738384186
H    1.9319860734  -3.0194071366   1.4084625651
H    3.0512283624   0.7722528247  -0.2299846010
H    0.0357802517   3.6099724278  -2.3828398628
H   -2.4538572461   0.8187226578  -4.4639616924
H   -4.7151516366  -0.8874818006   0.5767204364
H   -1.1585755287   2.9304189436  -4.4448086626
H    4.0724513336  -3.1388606903   2.6051449165
H    5.1938254765   0.6614593228   0.9623178806
H   -5.5051219567   2.7749925529  -1.1706336877
*