! 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  -1.9515419049  -0.7733788287  -2.3695129593
Cl  -4.8041499850   3.1131518572  -0.0819907110
F    4.2067490413   1.4254608568  -0.2387107497
F    3.6249573929   0.3437150941   1.5357293535
F    4.4163666662  -2.0175125571   0.3984153781
F    5.9765864496  -0.4906935503   0.4892330451
O    2.6183692976  -0.1356461727  -0.3991565663
N   -0.8750263406  -2.0056763710   0.9699969932
N   -0.9148243184  -3.0749773089   0.1710700285
N   -2.9050869933  -2.7591199504   1.1586592851
C    0.2446408639  -0.1838046306  -0.2297749357
C    0.2639370752  -1.1202051199   0.9850081262
C    1.4712975195   0.7172013495  -0.2516696306
C   -1.0167145507   0.6431661412  -0.2373362158
C   -2.0554850074   0.4469210842  -1.1447921684
C   -1.2094366658   1.6234433946   0.7351752669
C    3.7625820934   0.2183891700   0.1914610062
C   -3.2199145058   1.2006475732  -1.1102979498
C   -2.3599682479   2.3885644425   0.8007070733
C   -2.0684818902  -1.8227396803   1.5347590524
C   -3.3579643193   2.1696369391  -0.1336660115
C    4.8218708073  -0.8366710322  -0.1210219617
C   -2.1441498857  -3.4913142142   0.3244466754
H    0.2794655823  -0.8014295046  -1.1288761821
H    1.1648777734  -1.7304883968   0.9932322304
H    0.2385341298  -0.5556510454   1.9173075448
H    1.4240835368   1.3960771234  -1.1036566303
H    1.5416250062   1.3164042928   0.6579235216
H   -0.4440136707   1.7982818598   1.4807824793
H   -4.0056503984   1.0266526887  -1.8319271373
H   -2.4714737895   3.1389719779   1.5703605800
H   -2.2754092385  -1.0173312777   2.2221109825
H    4.9903313147  -0.9444019709  -1.1925645255
H   -2.5086097758  -4.3698418132  -0.1843788369
*
