! 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  -0.3543170245  -0.7530284840   2.6988356337
Cl   2.2637055452  -4.1870201402  -0.4173678872
O   -1.7403709433   1.0962167035   0.8938022389
O   -0.8084525255   1.6371995293  -1.0849638763
N    1.6926736190   2.2144200861   0.3090655638
N    1.9298676329   3.1040174732  -0.6601644823
N    3.7112359612   1.7686416931  -0.3675340356
C   -0.5289939143   1.1370271998   0.1914049560
C   -2.8127157875   1.3814185621  -0.0043109576
C   -2.1036447625   2.2172528534  -1.0548805353
C   -3.4586208601   0.1116441139  -0.5357818220
C    0.4070029585   2.0992801345   0.9487221346
C    0.1117613396  -0.2378505741   0.0496562747
C   -4.7746089622   0.3894062268  -1.2523075914
C    0.2486859225  -1.1231515144   1.1172715456
C    0.6739936262  -0.6179707532  -1.1661729614
C   -5.4219939066  -0.8781728195  -1.7869381384
C    0.8993957248  -2.3408685810   0.9815265825
C    1.3360884368  -1.8226272746  -1.3278260935
C    2.7565424886   1.4242619969   0.4597274063
C    1.4398646643  -2.6782233259  -0.2460079730
C    3.1469098468   2.7985068798  -1.0243482804
H   -3.5489577184   1.9704733319   0.5476682445
H   -2.5367539643   2.1459591091  -2.0522503510
H   -2.0572729460   3.2734364189  -0.7701960641
H   -3.6429615022  -0.5610324012   0.3064939388
H   -2.7700389378  -0.4096724554  -1.2094087110
H    0.5592468785   1.7601800914   1.9723803202
H   -0.0439593796   3.0902047456   0.9946215712
H   -4.6139259713   1.0879996155  -2.0785740412
H   -5.4613729406   0.8877480106  -0.5619098596
H    0.6071117245   0.0415260943  -2.0187628204
H   -4.7787460955  -1.3752954210  -2.5148397108
H   -5.6225761881  -1.5899384185  -0.9841233294
H   -6.3707951930  -0.6619229623  -2.2788332310
H    0.9847381164  -3.0096413010   1.8263544132
H    1.7648755637  -2.0796982614  -2.2857818705
H    2.8021588742   0.6327255478   1.1911657401
H    3.6554342445   3.3513592303  -1.7982668444
*
