! 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  -6.4222954872  -3.4725853022   1.1063577025
F    1.8594757128  -0.3594087260   1.8731597942
F    0.3337453425  -1.8053823505   1.5691367272
F    2.1626111692  -1.9970057610   0.4900011552
O    3.4968716339   0.2764236677  -0.1362976107
O   -2.5360598693  -0.3998084898  -2.0162760756
N    3.7862146359   3.0888037640   0.8209422958
N    4.8419386279   2.4062847951   1.2803729030
N    5.4204162176   4.5215638127   0.8236566056
C    2.6871917729   1.3493951417  -0.5544218453
C    1.2880897949   0.8040288852  -0.8436982610
C    2.5340096801   2.4240169741   0.5443914298
C    3.3316699724   1.9789077625  -1.7959276259
C    0.6675024615  -0.2791702879  -0.1943443485
C    0.5376508196   1.4660893432  -1.8154551022
C   -0.6087040625  -0.6900886186  -0.5808441234
C   -0.7394221696   1.0878120231  -2.1753385421
C   -1.3084185301  -0.0143405433  -1.5648433981
C    1.2773643680  -1.0966274126   0.9246174450
C    4.1513765909   4.3369967162   0.5405251276
C    5.7918614563   3.3084630851   1.2651369329
C   -3.3917257360  -1.1269199979  -1.2283705003
C   -4.0253109941  -2.2096396249  -1.8172412548
C   -3.6845872135  -0.7600868585   0.0783108460
C   -4.9666640146  -2.9314596102  -1.1004306209
C   -4.6150929104  -1.4900977286   0.8007598730
C   -5.2504343005  -2.5692470461   0.2060635180
H    1.8298589688   3.1880822608   0.2204879738
H    2.1513794003   1.9964493322   1.4683791033
H    4.3849455912   2.1862962320  -1.5996272603
H    3.2885964584   1.2929898999  -2.6420374049
H    2.8747840891   2.9210667934  -2.0969969007
H    0.9560843941   2.3216082978  -2.3239442803
H   -1.0640134243  -1.5510056145  -0.1142098640
H    4.2432432398   0.6346662965   0.3676359432
H   -1.2772009485   1.6364398353  -2.9370026990
H    3.4675772943   5.0725502821   0.1476712858
H    6.7935154662   3.0777302761   1.5916291365
H   -3.7949063956  -2.4864973374  -2.8372422868
H   -3.2074418166   0.0937724833   0.5414455188
H   -5.4639877624  -3.7726042505  -1.5626592502
H   -4.8454747129  -1.2049898499   1.8178150741
*