! 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  -1.6788495029   0.7390380287  -3.1059418739
Cl  -3.3149251556   3.6195149516   1.0858842714
F    2.6650161767  -0.0128486770   1.8376951557
F    3.8549556089  -1.2091755042   0.4943421306
F    4.4965466521   1.0275335416  -0.9646058256
F    5.0076210125   1.1469524483   1.1545468274
O    2.0937748776  -0.1006242646  -0.3204845808
N   -1.4282937217  -2.6747142134  -0.1378369943
N   -2.5770363714  -2.2163951640   0.3657851262
N   -1.6798692592  -3.7537960077   1.7329933431
C    0.0095534244  -0.8986610555  -1.1463874185
C   -0.8586316264  -2.1475304626  -1.3554222915
C    1.2473058958  -1.2580973232  -0.3447932411
C   -0.7898109084   0.2506065351  -0.5817344962
C   -1.6023835861   1.0359655938  -1.3980862309
C   -0.7937470778   0.5546475451   0.7767995686
C    3.1053569235  -0.0825997324   0.5543904681
C   -2.3824966449   2.0699202538  -0.9051249371
C   -1.5583393440   1.5813497537   1.3036279175
C   -0.9067060620  -3.5828219999   0.6893293954
C   -2.3498180539   2.3322389046   0.4524423661
C    3.9790345488   1.1401301605   0.2784945777
C   -2.6827247002  -2.8918870581   1.4802417485
H    0.3551031471  -0.6301188001  -2.1483326824
H   -1.6751875166  -1.9305452143  -2.0401022138
H   -0.2611684456  -2.9353172378  -1.8135300005
H    1.0066123829  -1.5849582405   0.6695121892
H    1.7644224502  -2.0784650265  -0.8463505361
H   -0.1908895658  -0.0192178565   1.4667592246
H   -3.0016138963   2.6555948426  -1.5700533284
H   -1.5332293394   1.7873857051   2.3643400636
H    0.0162075560  -4.1029617954   0.4842972747
H    3.4207341406   2.0725135064   0.3611949941
H   -3.5265498093  -2.7626408282   2.1393353787
*
