! 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    0.7619197375   1.9148709216   1.9872755751
F    4.3363258752  -1.5861301034  -1.0868075067
O   -1.0958108696  -0.1894263077   1.6455209994
N   -1.7326713279  -1.8171775391  -0.6008309363
N   -2.5152817059  -2.4945307009   0.2438832866
N   -1.1526580726  -3.8961298001  -0.8579270971
C   -0.7808990164   0.2582487461   0.3510363617
C   -1.7533698204  -0.3798061269  -0.6682446052
C    0.6260889012  -0.2119189789   0.0200552976
C   -0.8616401326   1.7786599701   0.2876233806
C    1.2437963601  -1.2311978915   0.7352892211
C    1.2867599324   0.3293684669  -1.0794364491
C   -0.0799171442   2.5394785357   1.1519243899
C   -1.6996442444   2.4795821227  -0.5747645663
C    2.4979396148  -1.6996713925   0.3673034354
C    2.5376185621  -0.1273289596  -1.4629678988
C   -0.1137352851   3.9177547895   1.1826839558
C   -1.7529455471   3.8676101511  -0.5682522340
C   -0.9214087558  -2.6636167895  -1.2374280173
C    3.1227525974  -1.1381813594  -0.7262766122
C   -0.9634365092   4.5872184689   0.3131883381
C   -2.1331400110  -3.7291202241   0.0499279213
H   -2.7782686677  -0.0597958787  -0.4796413400
H   -1.4998782043  -0.0856447719  -1.6856017697
H    0.7576878268  -1.6816522056   1.5884312727
H    0.8288270444   1.1226345181  -1.6576109033
H   -2.3287692290   1.9504794443  -1.2766410188
H   -2.0192740270   0.0196477247   1.8286177075
H    2.9765014615  -2.4924208379   0.9269871592
H    3.0463935233   0.2994501220  -2.3170160683
H    0.5163459706   4.4575253736   1.8773790973
H   -2.4143943126   4.3791597396  -1.2537111586
H   -0.2032687186  -2.3458765568  -1.9770137666
H   -1.0011395097   5.6678965306   0.3276908348
H   -2.5893131434  -4.5497104282   0.5810095385
*