! 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  -0.0731230546  -0.4011421054   2.1452319828
Cl   4.4441644020   1.3233308258  -0.1208977368
N   -1.3090841147  -1.8791889516  -0.7270535351
N   -1.9837782473  -2.5573765751   0.2037861261
N    0.0559832360  -3.4467584205  -0.0892181147
C   -1.5374912870   0.5710738367  -0.4324177614
C   -2.2574064642   1.7955693661  -1.0169602671
C   -1.8256368227  -0.6593275228  -1.3024412084
C   -0.0469738439   0.7699730368  -0.3135944713
C   -3.7486755799   1.8446871674  -0.6892599396
C    0.6965312205   0.3594995247   0.7907629385
C    0.6657377877   1.3437516204  -1.3661907707
C   -4.0384992411   2.1592858498   0.7711971861
C    2.0725934085   0.5262115967   0.8654963882
C    2.0372801615   1.5206974998  -1.3278404158
C   -0.0956046085  -2.4087810328  -0.8758083013
C    2.7301948896   1.1093580348  -0.2013195754
C   -1.1272464481  -3.4826075259   0.5494767265
H   -1.9444283426   0.3748674681   0.5611220624
H   -1.7854330065   2.7050885937  -0.6362522773
H   -2.1253308969   1.8163138382  -2.1023729610
H   -1.3777277713  -0.5393385063  -2.2892309454
H   -2.8970212081  -0.7891627646  -1.4458736584
H   -4.2100050243   2.6119195165  -1.3150487430
H   -4.2334588748   0.9051275594  -0.9688357822
H    0.1348462843   1.6668067576  -2.2524685476
H   -3.6333155800   1.4057209455   1.4485343763
H   -5.1119409054   2.2091683217   0.9566106770
H   -3.6093746791   3.1213493149   1.0570066280
H    2.6167191178   0.2013744213   1.7411330353
H    2.5522763144   1.9729091920  -2.1636951608
H    0.6273495914  -2.0293644294  -1.5809334917
H   -1.3713290832  -4.2256608889   1.2924137725
*