! 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  -0.4299337672   1.3627446390  -2.4698682829
Cl  -4.4084119656   4.4722750048  -0.7159812555
F    2.8527769470  -0.0647869953  -0.8170713620
F    3.4013652979   0.4852566492   1.1954309352
F    4.9001697812  -1.5260189665   0.2922288277
F    3.1410072259  -2.6942471283  -0.2571858881
O    1.5547308719  -0.7248549172   0.8769556620
N   -0.6177833202  -2.5328648983   0.9911154547
N   -0.4005652463  -3.2320519347  -0.1242498254
N    0.6774035068  -4.1628485269   1.6100727705
C   -0.6914257080  -0.1999044120   0.1629848493
C   -1.3715803353  -1.3018989064   0.9803278400
C    0.5872953405   0.3328465149   0.8009110582
C   -1.6206894121   0.9695380524  -0.0576414497
C   -1.5787453492   1.7312996348  -1.2253756558
C   -2.5384118268   1.3615375374   0.9135401328
C    2.8017874625  -0.4933141062   0.4693463181
C   -2.4269544277   2.8053394575  -1.4422389472
C   -3.3955611732   2.4338553391   0.7319354233
C    0.0389577252  -3.0883035518   2.0059975907
C   -3.3361496073   3.1424787997  -0.4547583754
C    3.6131344984  -1.7799929806   0.6181708653
C    0.3801155301  -4.1916396917   0.2984639533
H   -0.4375387999  -0.6271779711  -0.8097004149
H   -1.5065775132  -1.0115657434   2.0214752575
H   -2.3588650667  -1.5066335380   0.5664908839
H    0.9643949480   1.1772144618   0.2216997526
H    0.3925611342   0.6880360327   1.8150761570
H   -2.6026321551   0.8202629749   1.8475136241
H   -2.3760653661   3.3669607748  -2.3643149230
H   -4.0980516802   2.7033992009   1.5075652050
H    0.0141516738  -2.6877571602   3.0073581415
H    3.5656577858  -2.1788776396   1.6307620005
H    0.7413651178  -4.9569454062  -0.3700168104
*