! 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
Cl  -4.4271063416   2.1269848892  -0.2940540210
F   -0.1859693697  -1.7113489799   1.6551129539
F   -2.2598105972  -2.2059223739   1.4136403654
F   -0.8458635762  -2.7399429674  -0.1104489768
O    1.0990439099   1.0441003571   1.4093674208
N    2.8879455398  -1.3452801221  -0.7263956374
N    0.7812258910  -0.5553113927  -0.9769003753
N    4.8479181637  -2.3612853964  -0.7873402154
C    1.8258886621  -0.5517961418  -0.2718411556
C    2.1129194760   0.1761721223   1.0239332735
C    1.2723350549   2.3715889573   0.9407911240
C   -0.4123882380   0.1019943494  -0.7248052557
C    0.1179905358   3.2221504686   1.4206862788
C   -1.4182005718  -0.4648977700   0.0698085951
C   -0.7036790387   1.2713407482  -1.4266516113
C   -2.6489654776   0.1639229274   0.2024089165
C    2.8931343294  -2.1231436324  -1.8667927830
C    0.2059192191   4.6304549119   0.8536714819
C    4.0996972580  -1.5386439047  -0.1206560159
C   -1.1801277958  -1.7742963427   0.7556665686
C   -1.9261006429   1.9021636116  -1.2937237700
C   -2.8913185015   1.3477901117  -0.4696140682
C    4.1026122770  -2.7312256407  -1.8821250400
H    3.0701667158   0.7009181864   0.9170422312
H    2.2526445014  -0.5726857244   1.8083291825
H    1.3281199487   2.3945794069  -0.1549414286
H    2.2223015512   2.7765772812   1.3138818668
H   -0.8240375614   2.7605506662   1.1158070053
H    0.1194243279   3.2563865688   2.5128975860
H    0.0425859630   1.6918938539  -2.0866261622
H   -3.4247778989  -0.2650264313   0.8204399040
H    2.0584306538  -2.1666673632  -2.5421635873
H    1.1374214338   5.1208991752   1.1409235429
H    0.1597663200   4.6214044244  -0.2367168547
H   -0.6154858964   5.2497180259   1.2121121974
H    4.3824361758  -1.0617389853   0.8028779590
H   -2.1209934912   2.8165770087  -1.8368818720
H    4.4833996807  -3.4165619636  -2.6215409347
*