! 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   -2.4346448009  -2.1111478860  -0.5215823229
F   -1.8119786333  -1.3802987654   1.4043927897
F   -3.7847748781  -2.1861359517   1.1448300601
O    4.1760915950   0.4980033665   0.7217705582
O   -0.4563283421   1.5101537502   1.1211858257
N   -0.3597126387   0.2042156679  -0.7462708866
C    5.5804795847   0.2279818720   0.6218453071
C   -2.4867746254   1.0047736881   0.0193255598
C    0.9959330270  -0.1425952954  -0.8357362155
C    3.3084371762  -0.0458478552  -0.1571418746
C   -3.3601678827  -0.0697440113   0.2049891646
C    1.9825067807   0.3693639735  -0.0038749689
C   -0.9981523327   0.9191571616   0.2037523738
C    6.2081339417   1.0308450130  -0.5032526239
C    6.1766068200   0.5814737007   1.9684914639
C    1.3342716522  -1.0594261591  -1.8351097480
C    3.6496412370  -0.9624354435  -1.1466465036
C   -3.0046584629   2.2580966408  -0.2846393721
C   -4.7291503272   0.1184928054   0.0570816445
C    2.6489984341  -1.4545872848  -1.9756415202
C   -2.8504267367  -1.4348273494   0.5605013361
C   -4.3699845508   2.4392055325  -0.4381373782
C   -5.2320639707   1.3679034859  -0.2688705377
H    5.7325184818  -0.8420096192   0.4472097187
H    1.7541513997   1.0868990881   0.7677823151
H   -0.9368884118  -0.1694104204  -1.4854009805
H    5.7763845033   0.8003787235  -1.4773814980
H    6.0946856040   2.1016060551  -0.3261755176
H    7.2744663919   0.8114983850  -0.5609139107
H    7.2471028772   0.3785135135   1.9594339261
H    5.7340426556  -0.0106696440   2.7697920464
H    6.0391267229   1.6387124101   2.2011776284
H    0.5721436041  -1.4606682301  -2.4914691395
H    4.6647917041  -1.3028018738  -1.2913356541
H   -2.3340112130   3.0973833550  -0.4135831304
H   -5.4179901549  -0.7016890571   0.2026751675
H    2.9091611629  -2.1654077597  -2.7484644460
H   -4.7574523337   3.4182399141  -0.6843370496
H   -6.2991243648   1.5011170567  -0.3803137941
*