! 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    2.5924344900  -1.1718220407  -2.9559396199
F    2.6050766428  -2.2677074925  -1.0613702989
F   -1.9800957595   1.6960479890   3.3317180111
F   -1.9391642545   3.1217119184  -1.1081871473
F   -2.1887847261   3.6764258137   1.5170261402
O    2.0302650860  -0.5433073501   2.5285909632
N    0.7003424463  -1.9422708541   1.3932673702
N    1.6848754588   1.9658835762  -0.7628265473
N    1.7946102579   1.0321930201  -1.6997072574
C   -1.1633625395  -1.5528108776  -0.1786381381
C   -0.1594302904  -2.3679496280   0.3614323894
C    1.5613306256   0.0754430663   0.3220890760
C   -1.4303321853  -0.1762294813   0.2883081134
C    1.7259908166  -0.1194146117  -1.0642902361
C    1.4558199119  -0.8238567514   1.4825671009
C    1.5545499770   1.4478453074   0.4613448883
C   -1.9479229901  -2.0680852632  -1.2120467182
C   -0.0091441569  -3.6756966529  -0.0925027659
C   -1.5606337002   0.8454412164  -0.6494377501
C   -1.5805345093   0.1084881712   1.6438389337
C   -1.7865382456  -3.3645889320  -1.6690777835
C    1.8856014284  -1.3940430914  -1.8200879804
C   -0.8213603924  -4.1784315406  -1.0934181629
C    1.6595930170   3.3693077303  -1.1112992039
C   -1.8318648802   1.4037756255   2.0393795723
C   -1.8208805658   2.1290287514  -0.2234826883
C   -1.9475621079   2.4296397365   1.1190315709
H    0.7786548347  -2.5655768768   2.1864407812
H    1.4565648056   2.0648121872   1.3400834740
H   -2.7242978411  -1.4468662643  -1.6396717087
H    0.7649987350  -4.2962735454   0.3394789048
H   -1.4432575454   0.6548473006  -1.7079840480
H   -1.5172804916  -0.6663553360   2.3954598166
H    0.9471726826  -1.8757736591  -2.0986035815
H   -2.4211792418  -3.7404102967  -2.4598808440
H   -0.6893032412  -5.1972499208  -1.4313438558
H    0.6557059986   3.7762454274  -1.0113007177
H    2.3335426224   3.9246733112  -0.4646543792
H    1.9839774369   3.4796464863  -2.1405778021
*