! 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  -5.4147843555  -0.5615010200  -2.3342687545
S    1.5913917460  -0.6900739335   1.9635986087
O    2.4310842335   2.1936345177  -0.8554730798
O    1.9461236784  -1.6354512617   3.0004602002
O    1.6316967702   0.7332278956   2.2484989223
O    0.5780229877   0.9555893258  -0.6613167934
O    0.3346417080  -3.1198615881   0.8555832319
O   -2.8294339125   2.3009148334   0.8413407313
N    0.0189440268  -0.9651056850   1.4963635776
N   -1.5615727435  -2.0829322176   0.2066530034
N   -2.2062298826   0.1201151469   0.5771214874
N   -3.3631145294  -1.2793856652  -0.9287796232
C    2.6070867707  -1.0151473708   0.5446456179
C    2.7023432351  -0.0927201181  -0.5013093541
C    3.4068922976  -2.1459726283   0.5740402498
C    3.6246130839  -0.3270081081  -1.5113149905
C    4.3042327568  -2.3773199751  -0.4584273416
C    4.4155178265  -1.4677537870  -1.4950577374
C    1.7786303222   1.0694567541  -0.6565105512
C   -0.3503482541  -2.1189790942   0.8579574619
C    1.6552596387   3.3803888102  -1.1284003962
C   -2.4060303800  -1.0272868938  -0.0527418238
C    2.6159266060   4.5187110845  -1.3489061119
C   -3.0021394448   1.1291930316   0.2699387713
C   -4.0452549517   0.9910786065  -0.6487198287
C   -4.1598341479  -0.2620899559  -1.1968971916
C   -1.7544821648   2.4714359849   1.7670203581
H    3.3479885902  -2.8457650976   1.3942921612
H    3.7165021342   0.3719689342  -2.3315308667
H   -0.5802142717  -0.1416540031   1.3543361901
H    4.9195758381  -3.2655903016  -0.4393536038
H    5.1199527672  -1.6386772456  -2.2971913842
H   -1.7940906453  -2.9448457728  -0.2696756720
H    0.9963377887   3.5810906975  -0.2814627449
H    1.0361247439   3.2109592551  -2.0109486689
H    2.0450840624   5.4240600656  -1.5535074004
H    3.2313091951   4.7048166092  -0.4685715581
H    3.2689582661   4.3373493109  -2.2028662000
H   -4.7032704366   1.8091742515  -0.8977259278
H   -0.7894085642   2.3330691221   1.2801220459
H   -1.8448427327   1.7960244719   2.6172270003
H   -1.8300581305   3.4963965673   2.1173336733
*