! 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   0.4632139418  -0.3123050212  -1.9025513940
Cl  -4.4540412687   0.9989816041  -0.2378895347
O    0.4895579813  -3.1151341313  -0.1786935602
N    1.3920383933  -2.4175124139   0.5673524801
N    1.5443943280   3.0727160718   0.3402832226
C    1.8460541267  -0.4014836723   1.7602692769
C    0.9493444199  -1.2869896320   0.9459970298
C   -0.3965228418  -0.7605339248   0.6192152013
C    2.1647888814   0.8426609609   0.9762161528
C   -0.7156599702  -0.2743179249  -0.6441086608
C   -1.3650914725  -0.6869536630   1.6138826626
C    3.2197772678   0.8744323745   0.0734097303
C    1.3644641994   1.9747448661   1.0651500928
C   -1.9588536653   0.2708388581  -0.9203015388
C   -2.6199645197  -0.1573954011   1.3639223799
C   -2.9008484838   0.3184691454   0.0940648781
C    3.4267899221   2.0157122455  -0.6818375380
C    2.5572838587   3.0821436531  -0.5187280341
C    1.0786929656  -4.3019025899  -0.6754969038
H    1.3454758245  -0.1379040470   2.6958118150
H    2.7581896862  -0.9409804300   2.0155901605
H   -1.1361500047  -1.0511413305   2.6069402465
H    3.8692957063   0.0149079258  -0.0386861293
H    0.5350413152   1.9944063533   1.7649133870
H   -2.1858150206   0.6506530695  -1.9065494392
H   -3.3598239219  -0.1143479860   2.1504245511
H    4.2399319392   2.0790748568  -1.3914758061
H    2.6886666392   3.9854636695  -1.1025261838
H    1.4085368371  -4.9620276084   0.1297161289
H    1.9231759151  -4.0916057528  -1.3350860695
H    0.3035840315  -4.8066803710  -1.2486172497
*
