! 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  -0.7254857555   0.6850628728  -2.9049698989
Cl  -3.3609990216   3.5179498870   0.7784412318
F    3.5696566485  -0.6571875063  -0.7682800580
F    2.2613836994   1.0565171906  -0.8494625064
F    4.7470304816   1.6826438706  -0.0452457474
F    4.6409692860   0.2389699006   1.5882521382
O    2.0685058336  -0.3685001643   0.8663977458
N   -1.5574896258  -2.7113842443   0.1327282003
N   -1.1674440492  -3.4606686339   1.1696303230
N   -3.2687148211  -2.7365818104   1.4741241339
C    0.2248384477  -1.1272639569  -0.6109311082
C   -0.6526053785  -2.3486156366  -0.9305499441
C    1.2667529267  -1.4799399197   0.4450968042
C   -0.6298740585   0.0622046667  -0.2600463480
C   -1.1259669215   0.9248150373  -1.2357040799
C   -1.0277772449   0.3068413658   1.0524841552
C    2.9080404036   0.2277601285   0.0132476741
C   -1.9621904378   1.9884874534  -0.9339694451
C   -1.8643508983   1.3573700608   1.3884677932
C   -2.8030815896  -2.2797651293   0.3369230302
C   -2.3216169640   2.1948859780   0.3859995891
C    3.9049856070   1.0662646278   0.8129595657
C   -2.2253236614  -3.4489636804   1.9392457990
H    0.7501714111  -0.9329920488  -1.5475159516
H   -1.2501217624  -2.1402537611  -1.8164884743
H   -0.0307344458  -3.2123666229  -1.1617099311
H    0.8154823140  -1.8351760818   1.3680047461
H    1.8999680653  -2.2874876194   0.0730072617
H   -0.6857678505  -0.3374279328   1.8521106062
H   -2.3242885731   2.6406352001  -1.7163256124
H   -2.1513701311   1.5144618794   2.4185451175
H   -3.3331803330  -1.6576456641  -0.3671430574
H    3.4077479627   1.8086101521   1.4375748098
H   -2.2475704648  -3.9844051794   2.8753570831
*
