! 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   1.6362759821   2.1619457048   1.2941464624
Cl   5.6007786311  -0.9761053109  -0.3747190233
O   -1.0478135285  -0.9487850626  -0.5863860121
O   -0.7883090796   0.4555279066   1.1293236326
N   -2.0616421353   1.6299822215  -1.1384236533
N   -2.8543941908   1.1200637611  -2.0850778176
N   -4.0635654324   2.2669909357  -0.5818047172
C   -0.3344099362   0.1764237099  -0.1583265746
C   -1.6690236813  -1.5839313170   0.5360864627
C   -1.0947208553  -0.7998016287   1.7117977434
C   -3.1825282164  -1.4927180696   0.4173287103
C   -0.6520065588   1.3495738285  -1.0898315053
C    1.1695040494  -0.1012742461  -0.1781875702
C   -3.9227397001  -2.3623293421   1.4308152102
C    2.1048963221   0.7332466803   0.4331226393
C    1.6593521295  -1.2121788172  -0.8578887022
C   -3.8030844399  -3.8570672263   1.1676011164
C    3.4657870399   0.4724702835   0.3786118214
C    3.0123533291  -1.4986300584  -0.9273294145
C   -2.7965865633   2.2968527193  -0.2473102914
C    3.9065527966  -0.6475088807  -0.3037400280
C   -4.0364859210   1.5305551201  -1.7092276521
H   -1.3435834086  -2.6266973394   0.5630249792
H   -1.8034099092  -0.6425315270   2.5243901154
H   -0.1971847835  -1.2746797764   2.1221024587
H   -3.4797369594  -1.7855151492  -0.5933613353
H   -3.4877042565  -0.4497419002   0.5435824532
H   -0.3148968197   1.1178225281  -2.0981789887
H   -0.1259096450   2.2473020528  -0.7708217477
H   -4.9782668897  -2.0827563335   1.4123220862
H   -3.5763993607  -2.1373835742   2.4443581437
H    0.9687147466  -1.8806680183  -1.3508848995
H   -4.1610678089  -4.1090058033   0.1676152255
H   -2.7754899980  -4.2141262199   1.2480680315
H   -4.3971216262  -4.4281079244   1.8819414535
H    4.1676532703   1.1367933404   0.8630008687
H    3.3556736322  -2.3730781479  -1.4616015216
H   -2.3743702978   2.8026823253   0.6059210209
H   -4.9215259600   1.2953858509  -2.2793670125
*
