! 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  -1.6833145844   0.7760466280  -3.1028850896
Cl  -3.0284490542   3.5334944567   1.2710709727
F    2.7034918767  -0.2579125824   1.5791872957
F    3.9832048410  -1.3060402836   0.1960244868
F    4.9597169384   1.0907330194   0.9736828949
F    3.1607460112   2.1027349137   0.2597765964
O    2.1547507766  -0.2882309617  -0.5877803686
N   -1.4795743095  -2.6785785959  -0.1570685251
N   -0.8141214482  -3.5461043273   0.6123760400
N   -2.6728578965  -2.8418882297   1.6531428746
C    0.0041650497  -1.0198649391  -1.2767750852
C   -0.9499921904  -2.2149494445  -1.4173114048
C    1.2851702871  -1.4302003204  -0.5716904785
C   -0.7061519197   0.1503245001  -0.6422194209
C   -1.5204961691   1.0000239786  -1.3903837224
C   -0.6492382483   0.3903869448   0.7284656512
C    3.1527702819  -0.2377606961   0.2977507169
C   -2.2373606983   2.0406902231  -0.8209066301
C   -1.3509832663   1.4208729783   1.3301697689
C   -2.5712865601  -2.2593990762   0.4830748675
C   -2.1413118837   2.2408903769   0.5445866971
C    3.9639025972   1.0344999053   0.0609753586
C   -1.5703793548  -3.6125004902   1.6776315207
H    0.2810009979  -0.7577712537  -2.3009445527
H   -1.7915773366  -1.9426293075  -2.0519091896
H   -0.4451129086  -3.0493805249  -1.9016521974
H    1.1087027988  -1.7759935543   0.4471331281
H    1.7482533084  -2.2499581740  -1.1240784067
H   -0.0470221417  -0.2403734969   1.3671597760
H   -2.8576194373   2.6794267359  -1.4339279361
H   -1.2786040105   1.5741963791   2.3974560502
H   -3.2703167264  -1.5569616068   0.0568255043
H    4.3850939659   1.0720702846  -0.9434545213
H   -1.3169596367  -4.2526445343   2.5078625690
*