! 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  -1.0596070886  -0.4305488617  -2.0553953901
Cl  -3.2058799870   3.6362276695   0.6540425581
F    3.3826583830  -0.9347448378  -0.6241619232
F    1.9815444222   0.6589413969  -1.0129903541
F    4.5338743308   1.4494477303  -1.2530304701
F    4.9925145755   0.7725009250   0.7716769044
O    2.3629709394   0.0536464113   1.1068729978
N   -1.6338805434  -2.7714862335   0.4269253766
N   -1.5450911718  -3.5636674142  -0.6439405551
N   -3.6163523679  -2.7184647223  -0.4617204547
C    0.3103861481  -1.2641963797   0.6049883426
C   -0.4762556944  -2.4334213727   1.2163028023
C    1.5977720058  -1.1168469797   1.4108713680
C   -0.5364439756  -0.0173192157   0.5839694221
C   -1.2058447576   0.4220757817  -0.5557485486
C   -0.7398133470   0.7146478140   1.7517855637
C    2.8965671322   0.2182196599  -0.1109982187
C   -2.0259671165   1.5410672137  -0.5490646442
C   -1.5517326302   1.8341689833   1.7941079888
C   -2.8648520359  -2.2669985875   0.5125709373
C   -2.1875000309   2.2398803601   0.6328378866
C    4.0116644983   1.2596968284  -0.0206464813
C   -2.7547423287  -3.5027525201  -1.1350528274
H    0.5709404981  -1.5549777643  -0.4135789782
H    0.1521548329  -3.3202994101   1.2873633607
H   -0.8136888565  -2.1879315064   2.2231794433
H    1.3902139678  -1.0211434964   2.4757181925
H    2.2090913891  -2.0126051428   1.2872116036
H   -0.2585456563   0.4056551421   2.6707846044
H   -2.5287754443   1.8561843047  -1.4525811145
H   -1.6826916825   2.3773338496   2.7191627338
H   -3.1721927184  -1.6019853822   1.3044127149
H    3.6562144174   2.2101355360   0.3775523646
H   -3.0308593485  -4.0532098516  -2.0205246486
*
