! 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  -0.3164895199  -0.2345675567  -2.1031043651
Cl   4.0428664901  -2.0052861437   0.4285090177
O   -0.8195680637   2.5163679461   1.2084364822
N   -2.3745146952  -0.7372851737   0.7067038342
N   -3.2541326244  -2.1723375283  -0.7197776749
C   -0.9978834130   1.2993969042   0.5247634884
C   -2.0683410473   0.5357507328   1.3110732662
C    0.2842776948   0.5012193360   0.4462267612
C    0.6594753341  -0.2356273874  -0.6713897026
C    1.1182457564   0.4418551157   1.5599842448
C   -1.7236952241  -1.9259673990   0.9001738295
C   -3.2661288459  -0.9393140704  -0.2886277812
C   -0.0338613071   3.4730826099   0.5112633452
C    1.8124060993  -1.0072650790  -0.6926793708
C    2.2743676381  -0.3174229623   1.5718080907
C    2.6082932311  -1.0402669073   0.4375910523
C   -2.2870522435  -2.7975848133   0.0169997554
C   -0.6769277919   3.9279432413  -0.7609234170
C   -0.1317062507   3.7531221380  -1.9581151710
H   -1.3825565931   1.4821986943  -0.4843257421
H   -1.7423581446   0.3716349277   2.3386485660
H   -2.9812764495   1.1301915642   1.3450099667
H    0.8592523564   1.0045662809   2.4476048439
H   -0.9515279709  -2.0513548039   1.6405847140
H   -3.9109930063  -0.1502158565  -0.6435964180
H    0.0742647289   4.3124298868   1.2006323788
H    0.9716215101   3.0865100913   0.3074857886
H    2.0782780618  -1.5724721027  -1.5750033554
H    2.9005152423  -0.3442877438   2.4523885379
H   -2.0490837680  -3.8404680524  -0.1201558034
H   -1.6396270819   4.4220812751  -0.6692931981
H   -0.6142022507   4.1081392460  -2.8594395794
H    0.8243836991   3.2580863502  -2.0817600173
*