! 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   5.2819992061  -3.2779209680   0.3465553735
O   -1.9362226503   1.3868295206  -1.5793187504
N   -0.9234477944   2.5879906229   0.9067786613
N    0.1363590994   2.3175373187   1.6735481533
N    0.4958325352   4.1828699480   0.4826412545
C   -1.9356016113   0.6947880763  -0.3456462210
C   -3.1309901804  -0.2995577620  -0.3680488858
C   -0.6693304182  -0.2052865090  -0.1345909180
C   -2.5864007511  -1.5489510200   0.3221151959
C   -1.1725428646  -1.6435796563  -0.2273222684
C   -4.4905769588   0.2042143050   0.1313584609
C   -2.0635457554   1.6988392609   0.8120405951
C    0.5079517583   0.1111866444  -1.0579847305
C   -5.4943778918  -0.9432007692   0.2177186910
C   -5.0595547244   1.2976747962  -0.7703860029
C    1.7093285469  -0.7271474745  -0.7254150269
C   -0.6913507427   3.6979436368   0.2028363305
C    2.0588030668  -1.8282193224  -1.5004702195
C    2.4890009446  -0.4337272262   0.3915048057
C    3.1531570565  -2.6194001168  -1.1791959826
C    3.5855951013  -1.2106179260   0.7298062425
C    0.9561215213   3.2963997958   1.3839255584
C    3.9084835463  -2.3014891482  -0.0630940421
H   -3.2605438995  -0.5667334795  -1.4255953984
H   -0.3265560946  -0.0564828175   0.8934246450
H   -3.1826539484  -2.4365686238   0.1113960655
H   -2.5689133648  -1.4197484228   1.4101780791
H   -0.5378485723  -2.3422816085   0.3185509312
H   -1.2031879596  -1.9786421300  -1.2694214945
H   -4.3783861687   0.6063840731   1.1444827163
H   -2.1530959039   1.1843149371   1.7674254551
H   -2.9443932884   2.3267079698   0.6913899753
H    0.7919131723   1.1663731803  -0.9745309963
H    0.2256487127  -0.0593780436  -2.0991231514
H   -1.1100033639   1.8703547079  -1.6889309360
H   -6.4790333494  -0.5699839214   0.5051887080
H   -5.2055536296  -1.6919023411   0.9554435381
H   -5.6037283287  -1.4483122327  -0.7453741944
H   -6.0275974033   1.6388871622  -0.3999863003
H   -5.2116729194   0.9188971370  -1.7839384203
H   -4.4168899481   2.1739578902  -0.8481105770
H   -1.4130699081   4.1313450730  -0.4717437356
H    1.4727150782  -2.0780681557  -2.3764309407
H    2.2391380978   0.4193835211   1.0118011091
H    3.4104231147  -3.4692142589  -1.7967563782
H    4.1814140671  -0.9645305073   1.5982708039
H    1.9234880341   3.3797567558   1.8536950512
*