! 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   0.0218046833   0.9093109697  -2.0543799246
Cl  -5.2168705529   0.1950577766   0.1101822712
O    0.9598208880  -0.0323619373   2.2866801814
N    1.8580163623  -3.7307277275   0.8034529160
N    2.5982614263  -2.7202068778  -1.1974528468
C    0.7564457865  -0.1275537765   0.8889639192
C   -0.7487128273  -0.0829174129   0.6405578501
C    1.4774705822   1.0753504693   0.2706219407
C    1.3881126419  -1.4263228259   0.3972209753
C   -1.4623057792  -1.1401487278   0.0945150758
C   -1.4431123930   1.0568468147   1.0419705901
C    1.2079300655   1.6035270138  -0.9932768703
C    2.5075734867   1.6763885568   0.9958035564
C    1.3264790272  -2.5749284313   1.1773033048
C    2.0649267734  -1.5689216707  -0.8039176627
C   -2.8381821936  -1.0639214999  -0.0681568373
C   -2.8135947581   1.1519988750   0.8801708951
C    1.9054310391   2.6959748501  -1.4928689198
C    3.2186518541   2.7575062634   0.5032122118
C   -3.5020167426   0.0848254220   0.3226174929
C    2.9109237932   3.2787858177  -0.7430183849
C    2.4631683557  -3.7449829275  -0.3739434064
H   -0.9622066385  -2.0384935372  -0.2398658569
H   -0.9156586326   1.8987372688   1.4726490126
H    2.7698617655   1.2918788518   1.9698023705
H    0.2157040543  -0.4398879437   2.7435454279
H    0.8347303643  -2.5755034061   2.1424757154
H    2.2086927655  -0.7360288864  -1.4783266788
H   -3.3770518706  -1.8946294923  -0.5022986593
H   -3.3355919600   2.0482000871   1.1858527432
H    1.6624753187   3.0830272883  -2.4727504849
H    4.0103913533   3.1908296377   1.0988689610
H    3.4516555311   4.1276639620  -1.1383912715
H    2.8935236491  -4.6867086790  -0.6903682359
*
