! 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   0.4983936858  -1.0899979000   2.2626993499
Cl   0.8792485809  -5.2817565662  -1.0007052316
O   -0.5604972001   1.0696078433   0.5865832286
O    0.0968699371   1.3041678624  -1.5345012627
N    1.6879185187   2.6871316596   0.4391470038
N    1.5982815410   3.1048384332   1.7048099255
N    1.3597894204   4.8305290026   0.2891988018
C    0.4415024850   0.7110257484  -0.3171723630
C   -1.7175189139   1.5110302322  -0.1226024865
C   -1.3182080767   1.3341600238  -1.5855381519
C   -2.9454025638   0.7193029975   0.2774118180
C    1.7919613457   1.2887481732   0.1137647896
C    0.5469395702  -0.8069134644  -0.4574747676
C   -4.2002591265   1.2223055963  -0.4273511280
C    0.5654934336  -1.6728852283   0.6348944566
C    0.6650550773  -1.3759099354  -1.7218230273
C   -5.4408379434   0.4381551421  -0.0306297901
C    0.6655904097  -3.0470273427   0.4776133161
C    0.7674123386  -2.7440491277  -1.9090439533
C    1.5344429022   3.7221881394  -0.3883553625
C    0.7597908960  -3.5702085305  -0.7997930228
C    1.4099337011   4.3894746424   1.5602197980
H   -1.8686004481   2.5719137787   0.1076534428
H   -1.7159051045   0.4015926203  -2.0054524957
H   -1.6256141476   2.1602755425  -2.2242120686
H   -3.0848640863   0.7900008275   1.3596540490
H   -2.7844927832  -0.3391424319   0.0461861809
H    2.5120213421   1.1527567432  -0.6931710572
H    2.1806061759   0.7748406038   0.9893191259
H   -4.0709483534   1.1634531885  -1.5125991109
H   -4.3462796044   2.2814324060  -0.1958883128
H    0.6763895321  -0.7386039196  -2.5946043746
H   -5.6161465567   0.4910740485   1.0453475764
H   -6.3306723307   0.8241522910  -0.5288301743
H   -5.3454967746  -0.6158445057  -0.2972885279
H    0.6715523235  -3.6954390843   1.3425273288
H    0.8512395111  -3.1509889034  -2.9066684015
H    1.5785606957   3.6333743249  -1.4617215543
H    1.3055035522   5.0411820992   2.4135601592
*