! 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   -3.0227086690  -0.7118139670  -2.5212728624
F   -1.1622014121   0.2128507642  -1.9853458411
F   -1.7981826751  -1.5872692340  -0.9908514301
O    4.5324309910   0.0553009948  -0.2342140586
O   -1.4781204981  -1.2212354926   2.2125827173
N   -0.1193141049   0.0703478555   0.9130248707
C    4.3576397062   1.0365768157  -1.2648901700
C   -2.4887010497   0.4440299397   0.8740767387
C    1.1522476012  -0.4830310412   1.1205980848
C    3.4782738128  -0.4153557332   0.4612274418
C   -2.9401159048   0.4005623641  -0.4477755756
C    2.1791854395   0.0614997023   0.3429079094
C   -1.3144398108  -0.3372264124   1.3901166031
C    5.7224216502   1.6485870184  -1.4991457505
C    3.7963999442   0.4030557534  -2.5249527936
C    1.4224428992  -1.5037845395   2.0252840932
C    3.7532409198  -1.4463245118   1.3629357012
C   -3.1948194378   1.1896912004   1.8105553419
C   -4.0674574216   1.1247673614  -0.8166703204
C    2.7293092559  -1.9679012588   2.1270657682
C   -2.2345691606  -0.4216578198  -1.4854248642
C   -4.3141420436   1.9155755628   1.4360352511
C   -4.7484522275   1.8848057072   0.1207812847
H    3.6831550783   1.8220792223  -0.9087056697
H    1.9365965554   0.8583743015  -0.3484280051
H   -0.1376774858   0.8657789967   0.2920039102
H    5.6518865079   2.4228031704  -2.2625633950
H    6.1137822618   2.1113441641  -0.5928817836
H    6.4393400793   0.9021975378  -1.8452732848
H    4.4809632840  -0.3498127731  -2.9192388394
H    3.6590660928   1.1660983846  -3.2913733284
H    2.8283967103  -0.0722381741  -2.3638156588
H    0.6540714721  -1.9360800959   2.6425184379
H    4.7633362388  -1.8229193002   1.4583982401
H   -2.8608789369   1.2114962656   2.8395327537
H   -4.4333034145   1.0979308412  -1.8334105089
H    2.9465897418  -2.7630952441   2.8279723769
H   -4.8479787368   2.4984371473   2.1739526498
H   -5.6243977222   2.4428801153  -0.1791241805
*