! 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   6.3511419759  -1.2706385579   2.6347208468
N   -3.5094515227   1.2209960413   0.4235227995
N   -4.5131670991   0.4010458471   0.7524053655
N   -5.1887481399   1.8972649784  -0.7784975333
N   -2.4270000585  -2.3176728228   0.1731067840
C   -1.3422571181   0.0575076450   0.0357966082
C    0.0608990966  -0.0745510171   0.6677814924
C   -2.1745354737   1.0197480782   0.9189101346
C   -1.3081663907   0.5858225597  -1.3909834617
C    1.0038706524  -0.9883271118  -0.1112537169
C    2.3452066566  -1.0735023631   0.5590209537
C   -1.9650116826  -1.2664342617   0.0889547050
C   -0.5458641531   1.7189048749  -1.6704942718
C   -2.0834423469   0.0337705348  -2.4036595706
C    2.5977183543  -2.0366587699   1.5317470834
C    3.3548854722  -0.1671201398   0.2482276738
C   -0.5540779943   2.2804969600  -2.9372406980
C   -2.0923635526   0.5971347980  -3.6734566659
C   -3.9248512564   2.0929886876  -0.4983799020
C   -1.3285939709   1.7207711917  -3.9452041645
C    3.8239118842  -2.1046024616   2.1762894289
C    4.5878104963  -0.2178813748   0.8813692939
C   -5.4921677788   0.8505021043   0.0128616806
C    4.8109348692  -1.1911879455   1.8421376071
H   -0.0551900324  -0.4440736567   1.6894436492
H    0.4956375164   0.9232885558   0.7538025677
H   -2.2354654851   0.6462762269   1.9391737925
H   -1.6689768874   1.9834587013   0.9501855703
H    1.1261387932  -0.6154711293  -1.1300541198
H    0.5719539093  -1.9886565153  -0.1928444387
H    0.0585685232   2.1814149087  -0.9003738656
H   -2.6942134185  -0.8410954126  -2.2195000564
H    1.8289358959  -2.7542146974   1.7920794022
H    3.1846891803   0.5920943121  -0.5057732101
H    0.0457771544   3.1588047422  -3.1349347338
H   -2.7019161988   0.1524545600  -4.4487197968
H   -3.2864757899   2.8551130470  -0.9176783579
H   -1.3350856319   2.1594629465  -4.9340891542
H    4.0042636728  -2.8635314105   2.9254387108
H    5.3626034866   0.4908278832   0.6223908689
H   -6.4746842160   0.4070310726   0.0510381099
*