! 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  -0.8874935958  -0.0924363377  -2.3505985942
Cl  -5.3038015292  -0.9412280222   0.5606166338
O    0.8758310869  -2.0100669393  -0.4137708125
N    1.4456460744  -0.8215481910  -0.0692139914
N    4.4459180808   2.2719878937  -0.6735788076
C    1.0674148058   1.4087129295   0.7172257915
C    0.5938627376   0.0473048355   0.2981368135
C   -0.8656297339  -0.1990573691   0.3478001372
C    2.5516135502   1.5850890029   0.6320893674
C   -1.6352218127  -0.2894423772  -0.8072145522
C   -1.5067468732  -0.3293399250   1.5742496538
C    3.3969822529   1.2003518877   1.6641504158
C    3.1376602194   2.1149251645  -0.5098689039
C   -3.0008340524  -0.5135799450  -0.7565769809
C   -2.8701167036  -0.5598296763   1.6558718425
C   -3.6019247842  -0.6525673032   0.4839521498
C    4.7643078383   1.3581923091   1.5098722885
C    5.2387418631   1.8939471594   0.3233123443
C    1.8641068171  -2.9007184754  -0.8952392139
H    0.5576251672   2.1495467304   0.0937002173
H    0.7165447251   1.5982367743   1.7365836348
H   -0.9299382471  -0.2586177029   2.4872909887
H    2.9911901155   0.7836969693   2.5779584938
H    2.5097144453   2.4354635975  -1.3351259372
H   -3.5815765639  -0.5796870925  -1.6657676772
H   -3.3478078130  -0.6659883614   2.6193621097
H    5.4532677433   1.0700587447   2.2916758108
H    6.3037740769   2.0216288059   0.1706374671
H    2.3560508369  -2.5178186111  -1.7918932026
H    1.3438725969  -3.8229065927  -1.1472442740
H    2.6205781507  -3.1181375480  -0.1377837299
*
