! 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   0.8034344787  -0.7056350134  -2.1852171345
Cl   5.6651912534  -0.7569300852  -0.0121183305
O   -1.0318642622  -0.4591730185   0.0949155089
O   -0.4987112789   0.8463656134   1.8448625946
N   -1.9502383802   2.0820233575  -0.3537977435
N   -2.5657828869   2.7753443490   0.6099297202
N   -4.0702574076   1.8462372421  -0.7740306580
C   -0.2082309999   0.5837868467   0.4976742784
C   -1.5423253774  -1.1338799821   1.2376765583
C   -1.4967025808  -0.0497002521   2.3037980422
C   -2.9343024001  -1.6505114560   0.9503145581
C   -0.5347198644   1.8301886600  -0.3415855953
C    1.2686266354   0.2308686956   0.3480385283
C   -3.0084587623  -2.6281834747  -0.2145884301
C    1.7929635475  -0.3452165695  -0.8091000775
C    2.1595811904   0.5057627297   1.3809144661
C   -4.4261919166  -3.1266021893  -0.4485219431
C    3.1398499990  -0.6534043404  -0.9274982150
C    3.5097394373   0.2126277311   1.2882718420
C   -2.8590807560   1.5204091426  -1.1525232361
C    3.9871742867  -0.3716758495   0.1293595531
C   -3.8272248492   2.6067066518   0.3112965791
H   -0.8767241251  -1.9657171823   1.5018441333
H   -2.4558163127   0.4710459122   2.3945844655
H   -1.2173357911  -0.4372504474   3.2836134845
H   -3.5976370089  -0.7996241619   0.7625115414
H   -3.3006492013  -2.1329956538   1.8618603943
H   -0.2023566777   1.7078018431  -1.3707245756
H   -0.0196153540   2.6979868410   0.0659466431
H   -2.3455452023  -3.4775194870  -0.0252592991
H   -2.6388209524  -2.1425887932  -1.1209422001
H    1.7971005468   0.9599031366   2.2913304543
H   -4.8152013224  -3.6500743919   0.4268027449
H   -5.1053476618  -2.2996145106  -0.6644810511
H   -4.4724620143  -3.8168409641  -1.2915147832
H    3.5175671310  -1.1070686445  -1.8330270553
H    4.1715976463   0.4377010802   2.1125868982
H   -2.5976982081   0.9076571766  -2.0000995490
H   -4.6097464460   3.0626286120   0.8973276885
*