! 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  -0.8356383169  -1.2123720867  -2.6836425540
Cl  -4.4621422782   0.8959287830   0.6558409715
O    0.7069090197  -2.8901412055   0.6203135434
N    1.6083707863  -2.0994951095  -0.0287585015
N    1.9414777215   3.2222030791   0.8340663059
C    2.0321149317  -0.0132462218  -1.0939686890
C    1.1192291399  -0.9866846968  -0.4032186573
C   -0.2713160532  -0.5555470042  -0.1304058072
C    2.4267109170   1.0835216818  -0.1422076583
C   -1.2427618185  -0.5893547309  -1.1230157895
C   -0.6312058405  -0.0688395146   1.1219584933
C    3.5299122423   0.9495544481   0.6918407937
C    1.6738112631   2.2457173359  -0.0250273667
C   -2.5363307543  -0.1474764571  -0.8993580787
C   -1.9157910642   0.3807888312   1.3761645028
C   -2.8550715033   0.3368924024   0.3582745022
C    3.8276470632   1.9645092547   1.5851369203
C    3.0001885673   3.0754981350   1.6225746654
C    1.3360085181  -4.0765363738   1.0700714812
H    2.9177748830  -0.5389853420  -1.4500894530
H    1.5293190962   0.4095603346  -1.9662174856
H    0.1059014198  -0.0333766527   1.9128740323
H    4.1499098870   0.0630074793   0.6397666149
H    0.8112156768   2.3960506454  -0.6658291902
H   -3.2765274881  -0.1857526169  -1.6864115444
H   -2.1763265555   0.7589674978   2.3544226487
H    4.6832119643   1.8985156801   2.2425889229
H    3.2054629113   3.8840905349   2.3138703715
H    2.1300959112  -3.8675910322   1.7898201369
H    1.7462101132  -4.6586514864   0.2425666492
H    0.5613485543  -4.6613639094   1.5617452716
*
