! 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  -0.9984815323  -1.3689658998   2.5060201017
Cl  -4.1704460364   1.2096205202  -0.9623716502
O    0.6719363021  -3.0282887243  -0.7890507245
N    1.5807953639  -2.3350609862  -0.0472321776
N    1.7092616914   3.2273768950   0.0250406563
C    2.0578806213  -0.3416541441   1.1677442756
C    1.1393830557  -1.2135549290   0.3606340189
C   -0.1980434232  -0.6718844110   0.0249252066
C    2.3285215318   0.9434924768   0.4349637941
C   -1.2332748448  -0.6514492588   0.9500224328
C   -0.4271491827  -0.1064528960  -1.2256021838
C    3.3056457804   1.0267685048  -0.5487703224
C    1.5620954942   2.0780932920   0.6729042943
C   -2.4616288305  -0.0773320872   0.6634565748
C   -1.6433101882   0.4721430627  -1.5428000657
C   -2.6482990290   0.4826268404  -0.5886939014
C    3.4759509867   2.2212941118  -1.2290691120
C    2.6530221352   3.2888990114  -0.9080146322
C    1.2438274829  -4.2361506012  -1.2590269946
H    1.6018710158  -0.1267588158   2.1373955391
H    2.9864846334  -0.8801125124   1.3590465819
H    0.3636405502  -0.1074650094  -1.9638670527
H    3.9265973749   0.1694158584  -0.7789331363
H    0.7882529117   2.0536900450   1.4337694606
H   -3.2523081593  -0.0705177680   1.4004022752
H   -1.7994211528   0.9103195871  -2.5181343585
H    4.2292108491   2.3259199490  -1.9973666126
H    2.7597328863   4.2333885524  -1.4280107749
H    1.5357086630  -4.8948761758  -0.4381047382
H    2.1097130923  -4.0540794349  -1.8988191075
H    0.4703993748  -4.7269656790  -1.8463874241
*
