! 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   4.0883686914   3.6871373188   0.8131413227
O   -0.6677798750  -0.4230472995   1.1785314510
N   -1.4190807791  -2.9382846107  -0.1552650643
N   -0.3684505160  -3.2572748297   0.6105751922
N   -0.3331030444  -4.4436268588  -1.2892120459
C   -1.6587862641  -0.4860747158   0.1738672583
C   -2.7104842036   0.6141543914   0.5292998775
C   -1.0634848562  -0.2505679354  -1.2400899107
C   -2.3271560461  -1.8768367805   0.2236818328
C   -3.7634400126   0.7595106526  -0.5736291571
C   -3.4359876237   0.2875512364   1.8404806599
C   -2.0066225538   1.9640401657   0.7122255484
C    0.4290724933  -0.5497775379  -1.4236438414
C    1.3431311543   0.5005705910  -0.8516122686
C   -1.3753390983  -3.6432016463  -1.2829825779
C    2.2626505221   0.2029099318   0.1483078909
C    1.3040380863   1.8066805180  -1.3340270972
C    0.2485982021  -4.1605532014  -0.1121862663
C    3.1118317243   1.1709200245   0.6649147347
C    2.1405300970   2.7910808310  -0.8313452591
C    3.0383800534   2.4630630316   0.1718361429
H   -1.2225688732   0.7843150716  -1.5445978200
H   -1.6262224106  -0.8377637245  -1.9707207157
H   -2.6883299870  -2.0996277455   1.2263124469
H   -3.1755736718  -1.9346877842  -0.4549641603
H   -4.4918742588   1.5188487447  -0.2833597596
H   -4.3232343068  -0.1607125096  -0.7492248754
H   -3.3380936680   1.0759046117  -1.5261915076
H   -2.7422462007   0.0647389571   2.6514025481
H   -4.1258734701  -0.5524969053   1.7437652847
H   -4.0343420399   1.1457000842   2.1521752097
H   -2.7510413592   2.7378676779   0.9101338080
H   -1.3135362524   1.9555348160   1.5519077700
H   -1.4481148398   2.2768439379  -0.1711616592
H    0.6092745106  -0.6103986813  -2.5000234324
H    0.7095638216  -1.5273773048  -1.0287993690
H   -0.1714268464  -1.2523948326   1.1891611076
H   -2.1223258980  -3.5600062980  -2.0562632687
H    2.3273987026  -0.8057187267   0.5387383864
H    0.6106899533   2.0712007471  -2.1237481778
H    1.1540032055  -4.6353685537   0.2313011660
H    3.8170070118   0.9167793835   1.4446385191
H    2.0917600029   3.7987214476  -1.2213857282
*