! 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  -4.6882219943  -0.4175862097  -0.0360075237
O    1.8464810851  -1.3431692663  -1.1155911507
N    2.8979990307  -0.4427214315  -0.8018336478
N   -0.4702037558   2.4590661967   1.0230334942
C    2.4748192874   0.1519424109   0.4717045614
C    1.8945317318  -1.0606800474   1.2090368090
C    1.1799883812  -1.7851760317   0.0724445049
C    1.3948880789   1.1893819396   0.1876947349
C    3.6204458632   0.8176869012   1.2216842959
C   -0.2956101660  -1.4619547173  -0.0063054572
C    4.1383474108  -1.1989803274  -0.7552491782
C    1.2592552669   1.8103131016  -1.0458704601
C    0.5047309855   1.5752479170   1.1853306569
C   -1.1142808079  -1.7910283402   1.0704696683
C   -0.8674657840  -0.8327405844  -1.1048149870
C    0.2395480355   2.7296279343  -1.2350023885
C   -2.4634015603  -1.4776111520   1.0715064704
C   -2.2169940006  -0.5125977965  -1.1213666310
C   -0.6069001391   3.0099209261  -0.1779074917
C   -3.0037080238  -0.8327646649  -0.0296384141
H    2.7023954621  -1.6699254209   1.6168557601
H    1.2373462421  -0.8130733051   2.0386454301
H    1.3009326236  -2.8695846777   0.1652993468
H    3.2329279686   1.2979724676   2.1197459633
H    4.0968064257   1.5891247516   0.6160354304
H    4.3794031425   0.1020932808   1.5369244081
H    4.2808586958  -1.6887791589  -1.7168513277
H    4.1920639176  -1.9622228930   0.0287935307
H    4.9700229577  -0.5090440316  -0.6239490588
H    1.9282515244   1.5672297470  -1.8588068657
H    0.5807410024   1.1509057005   2.1801747966
H   -0.6987429667  -2.2922887239   1.9367084276
H   -0.2651065104  -0.5651813937  -1.9601000994
H    0.0999777809   3.2179221231  -2.1896346106
H   -3.0807838021  -1.7323677005   1.9218326972
H   -2.6421364008  -0.0097712706  -1.9791376736
H   -1.4216007155   3.7140989798  -0.2989991373
*