! 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  -0.9767680140  -0.4006958042  -2.0771146052
Cl  -3.1414365655   3.6566522582   0.6335636789
F    3.8125930310  -1.0565029995  -0.2840785851
F    2.2569428852   0.1514606281  -1.1627553624
F    3.2766220884   2.3892057755   0.0753863435
F    4.6908903161   1.3253308905  -1.2034348196
O    2.3814410019   0.0120461565   1.0682520477
N   -1.6574134134  -2.7489524884   0.4661210299
N   -1.5621247085  -3.5706050935  -0.5815260325
N   -3.6149010572  -2.6713737058  -0.4746442482
C    0.3138454987  -1.2844105102   0.6154694845
C   -0.5056975103  -2.4094104579   1.2638747731
C    1.6153167463  -1.1509995668   1.4009353048
C   -0.4996851719  -0.0162256971   0.5759655048
C   -1.1366399903   0.4432904967  -0.5735482287
C   -0.7225677076   0.7040600368   1.7481104893
C    3.0685239441   0.0584976010  -0.0791008823
C   -1.9450507266   1.5719192865  -0.5712345498
C   -1.5257126729   1.8289134769   1.7869080775
C   -2.8768810635  -2.2093207677   0.5047708903
C   -2.1301036184   2.2555772417   0.6157149574
C    4.0116752829   1.2609800432  -0.0366108094
C   -2.7558256773  -3.4918819541  -1.1076978688
H    0.5532633547  -1.6083373486  -0.3971225602
H    0.0985377912  -3.3075449158   1.3833309187
H   -0.8536661261  -2.1150964689   2.2535701948
H    1.4250027825  -1.0441473093   2.4679846578
H    2.2106486515  -2.0567310820   1.2748185054
H   -0.2670173108   0.3744464257   2.6734118337
H   -2.4245934188   1.9029013452  -1.4817730856
H   -1.6789607586   2.3585132937   2.7165979420
H   -3.1882524429  -1.5146898507   1.2691905988
H    4.7152755740   1.1952230723   0.7935667527
H   -3.0255186376  -4.0626536984  -1.9821250985
*
