! 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  -2.0568934951   4.9868318938   0.2831896050
N   -0.5864151683  -2.8797787177  -0.7402081239
N   -1.0103360704  -3.7619008589   0.1700344022
N    0.2792717797  -4.7730531254  -1.3631172148
N    0.2200087178  -1.7073786444   2.6006185700
C    0.0852404104  -0.6545203983   0.2118106612
C    1.5123460932  -0.7052145679  -0.3794031215
C   -0.9076092164  -1.4801145832  -0.6472336750
C    2.5263720552   0.1583236764   0.3589053012
C   -0.4509604486   0.7708908577   0.2720454607
C    3.9311668466   0.0454944626  -0.2267973100
C    0.1397608649  -1.2395352333   1.5519268024
C   -0.9560784723   1.3345874468   1.4367808184
C   -0.4590152134   1.5341938398  -0.8937817441
C    4.0475453324   0.5652665125  -1.6529051205
C   -1.4518023519   2.6306859974   1.4483044196
C   -0.9514328979   2.8278059395  -0.8990033480
C    0.1822966206  -3.4975346243  -1.6410002382
C   -1.4444476801   3.3684776041   0.2784174237
C   -0.4685732774  -4.8751762190  -0.2472701793
H    1.4437072563  -0.4042692262  -1.4269951357
H    1.8593353526  -1.7418878564  -0.3795466071
H   -0.9132500112  -1.0685161324  -1.6552732807
H   -1.9152828642  -1.3880888780  -0.2476892715
H    2.5581148051  -0.1336461596   1.4125116918
H    2.2121999139   1.2056145373   0.3386595909
H    4.2599752363  -0.9969739308  -0.1863781488
H    4.6166355556   0.6049818357   0.4138776980
H   -0.9740335884   0.7772580906   2.3639764389
H   -0.0751268533   1.1334358961  -1.8231411976
H    5.0818774006   0.5350015059  -1.9972774787
H    3.7079232046   1.6005706613  -1.7245483496
H    3.4586705874  -0.0232996017  -2.3578015346
H   -1.8368775424   3.0514107980   2.3667391642
H   -0.9454808043   3.4038636137  -1.8137784301
H    0.6301306490  -2.9878185807  -2.4794793550
H   -0.6248856272  -5.8066262885   0.2734323386
*