! 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   3.2911670504   2.5015208578   1.0211226711
Cl   5.2182739032   0.3842551619   0.7453405917
Cl   3.8199467636   1.3327118757  -1.5579445310
Cl  -2.9606983057  -1.0191358307  -2.3407324534
Cl  -3.5371871342  -2.1590030297   0.2441668402
Cl  -5.4146386930  -0.3689128473  -0.9997845743
O    3.3648296510  -2.6974295054   1.3401096453
O   -4.6579878275   2.7875728864   0.3944052534
N    1.2235838924   0.3888842386   0.4842744106
N   -1.5873300076   0.2754965315   0.0055082489
N    2.8440766550  -1.2361851295  -0.3311810725
N   -3.6652540380   0.8648870436   1.1136768811
C   -1.0462980337  -0.0553045625   1.3101042770
C    0.3651374390  -0.5810340344   1.1566796877
C   -0.7588172677   1.2754868214  -0.6402979350
C    0.6601518162   0.7707303351  -0.8035561252
C    2.5809255883  -0.0777389714   0.4901392593
C   -2.9964555777   0.5117266234  -0.1068305420
C    3.6510497824   1.0012089343   0.1798943734
C   -3.6937750286  -0.7117768836  -0.7638013853
C    3.1637755113  -2.4445412854   0.1660104048
C   -4.4424412283   1.9549745021   1.2553492294
H   -1.6293037187  -0.8406632837   1.7907588068
H   -1.0411622017   0.8095927968   1.9876605378
H   -1.1505967120   1.4884596801  -1.6350820106
H   -0.7514158173   2.2237358448  -0.0827156921
H    0.3274485732  -1.5408275986   0.6228685251
H    0.7665065091  -0.7777188583   2.1524776934
H    1.2360089666   1.5833335331  -1.2407716303
H    0.6556078288  -0.0599848685  -1.5235036682
H    2.7930820761  -0.3717738120   1.5193929450
H   -3.1674203653   1.3325738183  -0.8061722955
H    2.6654480844  -1.1866018368  -1.3226672584
H   -3.5954012409   0.2498600940   1.9102854176
H    3.2267293556  -3.2053600065  -0.6221480643
H   -4.8698194160   2.0197123923   2.2638525449
*
