! 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   0.6179587013  -1.2943527521   2.4671249654
Cl   4.3515581044  -1.4880576647  -1.3238043793
O   -2.0239537263   0.2971892439  -0.8297777119
O   -1.9548946269  -0.9756279816   1.0093203352
N   -0.3466541738   2.2765707996   0.7050796219
N   -0.6450274900   3.0125976050  -0.3683834685
N    1.4752723076   3.3809929259   0.2736072174
C   -1.2707005582   0.0258378264   0.3197516363
C   -3.0073142800  -0.7252895456  -1.0154133267
C   -2.5911066244  -1.7641884947   0.0176511309
C   -1.2358238261   1.2699163396   1.2197824388
C    0.1418652868  -0.4057599790  -0.0786265457
C   -4.3993548215  -0.1540578286  -0.8044898088
C   -5.4919388119  -1.1341889201  -1.2016099227
C    1.0398058091  -0.9877992131   0.8146113333
C    0.6039481889  -0.1549213132  -1.3673401890
C    2.3307039013  -1.3298110465   0.4410382110
C    1.8894299790  -0.4781809727  -1.7667164644
C    0.9197040513   2.4959491424   1.0619804614
C    2.7429160532  -1.0696076916  -0.8534118233
C    0.4727754652   3.6558514727  -0.5814608523
H   -2.9151059756  -1.1176000773  -2.0320182294
H   -3.4250849449  -2.2927731247   0.4774051439
H   -1.9014419982  -2.5035935739  -0.4027540821
H   -0.8914813703   1.0049359780   2.2172465585
H   -2.2400811951   1.6812995254   1.3123125453
H   -4.4960440620   0.7554610019  -1.4020251383
H   -4.5207358904   0.1413423205   0.2420119173
H   -5.3991456403  -1.4310056986  -2.2475884552
H   -5.4704779108  -2.0429181434  -0.5977332383
H   -6.4768848481  -0.6861359574  -1.0738800049
H   -0.0548723615   0.3056671569  -2.0883530602
H    3.0022282925  -1.7859330404   1.1548664976
H    2.2125893827  -0.2696383286  -2.7767186623
H    1.3831270005   2.0118081839   1.9075386986
H    0.5679011168   4.3647455075  -1.3888600429
*