! 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  -4.6461183483   1.9642135389  -0.1970393363
F   -1.1688662833  -2.9915212566  -0.3169627580
F   -0.4422957729  -2.0294935719   1.4643327018
F   -2.5286063468  -2.5018984015   1.2690420800
O    2.5150774362   1.4391105838   0.5511750165
N    2.7198522177  -1.2080101862  -0.5689058400
N    0.5296800539  -0.7568163333  -0.9795783492
N    4.7943432283  -1.9466477951  -0.4166027174
C    1.5429785982  -0.5327812580  -0.2558143414
C    1.6161954200   0.4183024909   0.9101177325
C    2.3501122652   2.6331416017   1.3028860960
C   -0.6772491211  -0.1017883791  -0.7504210992
C    1.2994887373   3.5557231334   0.7085544095
C   -1.7035863276  -0.7162122134  -0.0242858614
C   -0.9046093577   1.1559483562  -1.3013453221
C   -2.9245933772  -0.0784572790   0.1453071662
C    2.9186449845  -2.0459393143  -1.6489783468
C    1.1968385298   4.8532636931   1.4963451280
C    3.8953528670  -1.1929144541   0.1336930556
C   -1.4661461473  -2.0593698340   0.5936659577
C   -2.1188236406   1.7968119078  -1.1327022584
C   -3.1222604569   1.1724280236  -0.4112584565
C    4.1945798145  -2.4813695788  -1.5346236736
H    1.9428195737  -0.1114657942   1.8138013171
H    0.6144216901   0.8035093990   1.1156935148
H    3.3224401787   3.1306495251   1.3020298494
H    2.1107523588   2.4003538854   2.3476812114
H    1.5611848434   3.7713120104  -0.3304792730
H    0.3236547111   3.0619973797   0.6926451256
H   -0.1189554382   1.6373837922  -1.8679320435
H   -3.7196717776  -0.5441435665   0.7099972900
H    2.1535037047  -2.2435448529  -2.3778632854
H    2.1503688536   5.3837407897   1.5172585577
H    0.4593528871   5.5226110080   1.0538709813
H    0.8969460659   4.6715288144   2.5296864430
H    4.0347131991  -0.6244885205   1.0376771858
H   -2.2736174669   2.7778153748  -1.5601676399
H    4.7214858808  -3.1534749415  -2.1922821890
*