! 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   0.0579189058  -1.1609266210   2.8585451948
Cl  -4.5589727814  -1.4804062848   0.1597537782
O    3.3822405931  -0.9660638213  -0.5491663957
N    2.0757429768  -1.3375458949  -0.4560799245
N    2.0024629286   3.2185114498  -2.1792105376
C    1.7850708177   0.8313784573   0.7239874359
C    1.3480141044  -0.4978439280   0.1654997543
C   -0.1008274743  -0.8033753295   0.1831495550
C    1.4069260018   1.9082159576  -0.2580919948
C   -0.7990182923  -1.0588963759   1.3593187117
C   -0.8219013983  -0.7845275079  -1.0071255563
C    0.1486458147   2.4980600822  -0.2419639487
C    2.2895758357   2.3106464118  -1.2543636876
C   -2.1678079316  -1.2699000672   1.3689290996
C   -2.1894711893  -0.9979638831  -1.0312578003
C   -2.8496163032  -1.2299422546   0.1636142734
C   -0.1655438167   3.4441600804  -1.2034597511
C    0.7926378991   3.7676193536  -2.1498116456
C    4.1286461761  -1.9709655435  -1.2120526675
H    1.2819850704   1.0140923425   1.6738584123
H    2.8556057495   0.8461969513   0.9206068104
H   -0.3035058506  -0.5854131637  -1.9350859621
H   -0.5759041281   2.2273046603   0.5165913503
H    3.2819069316   1.8748403095  -1.3011955877
H   -2.6876374863  -1.4691739134   2.2953597269
H   -2.7274689989  -0.9726998063  -1.9680892926
H   -1.1333170988   3.9255308665  -1.2197976405
H    0.5757680255   4.5042823033  -2.9140072039
H    5.1525813604  -1.6063785846  -1.2560366431
H    3.7686167317  -2.1384341660  -2.2290730315
H    4.1130663272  -2.9160468379  -0.6656048320
*
