! 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  -0.8984993780  -0.3247707692  -2.4068601714
Cl  -5.2937485495  -0.9248234828   0.5940751213
O    0.8903501812  -1.9917078258  -0.3442911022
N    1.4493981883  -0.7762508398  -0.0888531314
N    4.5699040570   2.1246193220  -0.6386192749
C    1.0561543577   1.5014215817   0.5336517886
C    0.5903911755   0.1096214589   0.2171225007
C   -0.8668998903  -0.1444758909   0.2888597060
C    2.5457572095   1.6506010484   0.5622911316
C   -1.6370866914  -0.3691153581  -0.8476266809
C   -1.5054836783  -0.1516771649   1.5239343800
C    3.2820318962   1.4008733737   1.7125255137
C    3.2483388512   2.0124186856  -0.5796421575
C   -2.9992569086  -0.6067890787  -0.7683906334
C   -2.8647552175  -0.3924828300   1.6346373572
C   -3.5966679190  -0.6208422475   0.4815413651
C    4.6616083787   1.5169451390   1.6692359910
C    5.2574929685   1.8746427340   0.4707570090
C    1.8795491785  -2.8968215909  -0.7960706115
H    0.6154199138   2.1793435755  -0.2042304334
H    0.6261185440   1.8022138650   1.4937040225
H   -0.9289465919   0.0240495617   2.4228616845
H    2.7831530710   1.1185969441   2.6316771953
H    2.7083304782   2.2215448416  -1.4975961211
H   -3.5806268503  -0.7788145809  -1.6632207616
H   -3.3391273952  -0.4027403037   2.6055574278
H    5.2670972242   1.3312245413   2.5454871540
H    6.3348164203   1.9694654953   0.4051465930
H    1.3692988359  -3.8429438301  -0.9676296014
H    2.6642964991  -3.0488537726  -0.0514497654
H    2.3347633973  -2.5680321587  -1.7327890321
*
