! 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   3.4960161599   1.1683181092  -1.3078605673
Cl   2.7800298736   1.8369858290   1.4033601342
Cl   5.2705729697   0.5161708865   0.8588617917
Cl  -5.0640519890   0.4062910369  -1.0583473346
Cl  -3.6995957589   0.9859063182   1.3951847707
Cl  -2.5997344265   1.8765925660  -1.1030575305
O    4.5173703209  -2.8223963313   1.6336500525
O   -4.2063447665  -2.9611071926  -1.5609367170
N    1.4769496254  -0.6289215031   0.2728478428
N   -1.2955606479  -0.8077515046  -0.1983481347
N    3.5807955683  -1.7582741255  -0.1523005889
N   -3.4168360013  -1.8023639831   0.2364257226
C   -0.3729274048  -0.4894919571  -1.2737131590
C    0.9815578238  -1.1151986394  -1.0005318518
C   -0.8010672317  -0.3922903036   1.1007706502
C    0.5743923824  -0.9845339205   1.3504647225
C    2.8695251433  -0.7409671194   0.5704883067
C   -2.6892161900  -0.7914349955  -0.4860565716
C    3.5695637229   0.6347713907   0.3782260474
C   -3.4606264601   0.5583895180  -0.3085828689
C    4.3581647621  -2.6881379230   0.4346022472
C   -4.1129618637  -2.7861238779  -0.3593112897
H   -0.2257422999   0.5876947322  -1.4064162932
H   -0.7650949926  -0.8854086357  -2.2116641734
H   -0.7335466413   0.6994473529   1.1912159333
H   -1.4604779603  -0.7466800382   1.8935618130
H    1.6435727634  -0.8290236080  -1.8170700667
H    0.8929853801  -2.2106475647  -1.0183270175
H    0.4902921511  -2.0747240059   1.4724188108
H    0.9495263245  -0.5804195099   2.2910258787
H    2.9913692214  -0.9673447329   1.6313598580
H   -2.7937734573  -1.0226987935  -1.5474508893
H    3.5689951576  -1.7480277054  -1.1612665539
H   -3.4290929578  -1.7775582867   1.2448566611
H    4.8407557777  -3.3389946536  -0.3053143257
H   -4.6027722488  -3.4386485562   0.3741517196
*