! 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
F   -3.6041531649  -0.3680353730   2.6703176143
F   -3.4826142878  -1.9096760072   1.1846290371
F   -1.6989343339  -0.8930003595   1.8341506396
O    4.7850560323   0.3393568772  -0.2041837967
O   -1.3981211971  -1.7617318982  -0.9990025453
N    0.0452276052  -0.0044819943  -0.8038534238
C    4.6814883362   1.6266442420   0.4191542079
C   -2.2965516253   0.4005074865  -0.6195632880
C    1.3021599227  -0.6150948345  -0.9127926726
C    3.6794485946  -0.3426450538  -0.5651812776
C   -3.1818614684   0.3136442453   0.4582993240
C    2.3874807099   0.1622960790  -0.4991043753
C   -1.1766985162  -0.5781240824  -0.8164253882
C    4.2733078086   1.4903416557   1.8749131898
C    6.0391275745   2.2798939576   0.2703481804
C    1.5040530310  -1.9004820816  -1.4029198475
C    3.8870059634  -1.6379686536  -1.0450974617
C   -2.4933932089   1.3767429707  -1.5876272420
C   -4.2497622480   1.1958981888   0.5459356472
C    2.8046290850  -2.3891798609  -1.4577849824
C   -2.9923317739  -0.7146455154   1.5341654581
C   -3.5689921278   2.2488614423  -1.5013796696
C   -4.4473466497   2.1563483979  -0.4356447278
H    3.9471338044   2.2340141332  -0.1199076324
H    2.1923045729   1.1590685430  -0.1253385709
H    0.0673650324   0.9773293518  -0.5686626662
H    3.3030282018   1.0085433206   1.9981251674
H    5.0122902283   0.9124219274   2.4322949384
H    4.2050726625   2.4776882483   2.3320300851
H    6.3218638403   2.3784088962  -0.7779674731
H    6.8145397246   1.7129065076   0.7878817189
H    6.0130641749   3.2801444074   0.7014088171
H    0.6881175635  -2.5160017063  -1.7416787009
H    4.8908174890  -2.0393377317  -1.0950517576
H   -1.8132559393   1.4482192449  -2.4263930088
H   -4.9373347439   1.1513015537   1.3788646754
H    2.9708963662  -3.3892409124  -1.8359759505
H   -3.7158607746   2.9977019846  -2.2675550476
H   -5.2863349999   2.8336797858  -0.3576840094
*