! 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  -0.2534230848  -0.2457838892  -2.0130498281
Cl   4.9605611116  -0.2388220427  -0.9949605613
O   -1.6432084906  -0.4408134796   0.5101821519
O   -0.6755904193  -0.0777091514   2.4688525827
N   -1.1871453124   2.3701923501  -0.1920857803
N   -0.1339574455   2.9486085158  -0.7763764218
N   -1.8884276545   2.9107551908  -2.1757782883
C   -0.6764710596   0.3390275560   1.1296846061
C   -1.5339043888  -1.7471193220   1.0668496767
C   -0.9501066244  -1.4732333619   2.4655933690
C   -2.8907598744  -2.4176961133   1.0703203427
C   -1.1169148421   1.8038044440   1.1280212031
C    0.7185136624   0.1567601016   0.5250913873
C   -2.8174607073  -3.8550350016   1.5723692520
C    0.9880507484  -0.0925916293  -0.8190716457
C    1.8144640544   0.2976369132   1.3745484042
C   -4.1806922847  -4.5280833948   1.5899769599
C    2.2885376137  -0.2212243694  -1.2895012793
C    3.1196240268   0.1849388774   0.9314258919
C   -2.2155191087   2.3454913506  -1.0408829649
C    3.3433370154  -0.0815814846  -0.4076772202
C   -0.6040171009   3.2499420413  -1.9579903521
H   -0.8308219581  -2.3431225202   0.4716214995
H   -1.6609132679  -1.6806428270   3.2679519021
H   -0.0429591286  -2.0536017689   2.6482565289
H   -3.2966216215  -2.4119953396   0.0547841702
H   -3.5781268818  -1.8382688040   1.6951648174
H   -0.4260366475   2.4000907660   1.7215026072
H   -2.1030423443   1.8752708642   1.5869873817
H   -2.3914585647  -3.8796803124   2.5799464564
H   -2.1334971730  -4.4265729108   0.9387847260
H    1.6502286197   0.5024229529   2.4231781705
H   -4.8765163650  -3.9965889540   2.2414939734
H   -4.6215877814  -4.5574092795   0.5920060610
H   -4.1118352492  -5.5549674235   1.9499201176
H    2.4690854416  -0.4224542236  -2.3361625764
H    3.9415275791   0.3015901472   1.6233840297
H   -3.1768705037   1.9290498459  -0.7862065947
H    0.0057929660   3.7499590266  -2.6939785473
*