! 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   5.2967156916   3.2804967200  -0.5418846421
O   -2.0164334997  -1.1995953977   1.3926209281
N   -0.7660056738  -2.8058496046  -0.6905142588
N    0.3939990382  -2.6147905518  -1.3258977165
N    0.5983531279  -4.2551819833   0.1890960970
C   -1.9245842274  -0.7387440153   0.0606708577
C   -3.1580945755   0.1357485482  -0.2266270693
C   -0.7157950300   0.2272241398  -0.1664012917
C   -2.7462488556   1.5020209701   0.3120383603
C   -1.3180187595   1.6500501038  -0.1996195769
C   -4.5298956463  -0.4029349805   0.2182260574
C   -1.9046689600  -1.9389012772  -0.8951756225
C    0.3968799938   0.0812685393   0.8803044460
C   -4.9009010821  -0.0774865927   1.6626490953
C   -5.6155896671   0.1262632648  -0.7166860412
C    1.6184920399   0.8844599616   0.5325342241
C   -0.6250835646  -3.7795250685   0.2109957630
C    1.9285967067   2.0600178801   1.2091608834
C    2.4713484908   0.4683598969  -0.4882969025
C    3.0541352730   2.8056004181   0.8854885405
C    3.6006111324   1.1970134188  -0.8260556695
C    1.1757428230  -3.5032434542  -0.7659078889
C    3.8824830956   2.3644630464  -0.1322398133
H   -3.1914129114   0.2317308654  -1.3209122884
H   -0.2777731982   0.0013387396  -1.1413613782
H   -2.7635726604   1.5084729346   1.4047331226
H   -3.4012978714   2.3072351596  -0.0252283222
H   -1.3302477225   2.0240177773  -1.2254754688
H   -0.7367883862   2.3656553627   0.3847099524
H   -4.5222585253  -1.4942025149   0.1160141101
H   -1.8859242987  -1.6073945398  -1.9316691940
H   -2.8035081411  -2.5412586629  -0.7582304791
H    0.7048643721  -0.9659697583   0.9754982515
H    0.0318659856   0.3951564250   1.8610609711
H   -1.1643140239  -1.5391073271   1.6847205620
H   -5.0354735395   0.9963193454   1.8097949698
H   -5.8472325018  -0.5554298598   1.9232550497
H   -4.1536018830  -0.4186210438   2.3760827048
H   -5.6481898241   1.2187189558  -0.7086199542
H   -6.6034833252  -0.2308574433  -0.4195890263
H   -5.4481721797  -0.1907835470  -1.7475811625
H   -1.4335830749  -4.1258037267   0.8356213239
H    1.2879704110   2.4044736873   2.0117744996
H    2.2551922011  -0.4458939014  -1.0290335132
H    3.2784901780   3.7152719402   1.4258907674
H    4.2541740152   0.8550587565  -1.6170574236
H    2.2048089149  -3.6195760554  -1.0682961251
*