! 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   5.3077839821   3.3568069059  -0.4452531589
O   -1.8667426553  -1.3246544580   1.3548625816
N   -0.8787205460  -2.8731004207  -0.8528950251
N    0.3057154750  -2.7397258966  -1.4587474850
N    0.3210332669  -4.5294485577  -0.1076840859
C   -1.8551345245  -0.7713463236   0.0573158156
C   -3.0949318645   0.1616014259  -0.0923889459
C   -0.6042750536   0.1362626664  -0.2212690549
C   -2.5183125403   1.5731929909   0.0128985388
C   -1.1942426656   1.4583191801  -0.7192964265
C   -4.2879530279  -0.1066275058   0.8340652073
C   -1.9376803164  -1.8970425792  -0.9896782398
C    0.3014763247   0.3383942158   1.0025711424
C   -5.3577765866   0.9655514948   0.6328253155
C   -4.9174291287  -1.4807813451   0.6210227710
C    1.5491926975   1.0989899882   0.6522202266
C   -0.8489452480  -3.9386238109  -0.0496235189
C    1.7537167216   2.4026677997   1.0919542374
C    2.5351443617   0.5091910998  -0.1376289464
C    2.9044514488   3.1057781399   0.7608333503
C    3.6899002908   1.1934833817  -0.4809016717
C    0.9847882036  -3.7515407262  -0.9819303272
C    3.8642289463   2.4921299333  -0.0256910583
H   -3.4585161073   0.0453893710  -1.1237019795
H    0.0106987524  -0.3148284371  -1.0023624665
H   -2.3615561810   1.8462381171   1.0621436007
H   -3.1716738802   2.3295481402  -0.4218693009
H   -1.3771270507   1.4052695479  -1.7959030835
H   -0.5283485970   2.3075756293  -0.5567217912
H   -3.9459333712  -0.0390564122   1.8712046877
H   -1.8873444424  -1.4857991220  -1.9966272307
H   -2.8835190106  -2.4303640092  -0.9040424479
H    0.6135461316  -0.6257882014   1.4136236399
H   -0.2339834327   0.8569616095   1.8009061310
H   -1.0317656998  -1.7668131139   1.5347952788
H   -6.2319369081   0.7581406527   1.2528426616
H   -5.0052574983   1.9622538117   0.8989153531
H   -5.6944898766   0.9989267457  -0.4067480730
H   -5.2638036648  -1.5993554443  -0.4088413257
H   -5.7857299600  -1.6087232712   1.2702782621
H   -4.2334912321  -2.2991189077   0.8408405693
H   -1.6971644233  -4.2602053814   0.5342995398
H    1.0066517673   2.8858477578   1.7097056496
H    2.4058746349  -0.5074621014  -0.4921813401
H    3.0452470056   4.1178057675   1.1156044173
H    4.4446275999   0.7173105569  -1.0919923050
H    2.0024471494  -3.9397631713  -1.2860547133
*