! 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   0.5813491496   1.9855418570   1.1824089776
Cl   5.0691263287  -0.1339994442  -0.7058780163
O   -1.3231909026  -1.8163129663  -0.3207855120
O   -1.4975483844  -0.0111139858   0.9621802473
N   -1.3835871606   1.6594879529  -1.4434405947
N   -0.3311076784   2.1808259233  -2.0799001650
N   -1.4963003706   3.7904040419  -1.0359723612
C   -0.9565803098  -0.4654109513  -0.2350168567
C   -1.5163361050  -2.3252635374   1.0040813545
C   -1.3310588752  -1.0788454861   1.8786605708
C   -2.8897386790  -2.9625928567   1.1019246426
C   -1.6371617682   0.2442762444  -1.4080830239
C    0.5685742666  -0.3350592956  -0.2888356684
C   -3.1009009939  -3.7006460820   2.4177083449
C    1.3076130533   0.6963742205   0.2876811982
C    1.2779641588  -1.2932795189  -1.0110724448
C   -4.4745713737  -4.3479084851   2.4999641324
C    2.6898800585   0.7575348280   0.1684947872
C    2.6529861578  -1.2508205521  -1.1547782843
C   -2.0568312892   2.6270548876  -0.8194551037
C    3.3501638494  -0.2178243518  -0.5539198755
C   -0.4425513064   3.4531322954  -1.8027552188
H   -0.7428000056  -3.0687596175   1.2204311280
H   -2.0807331304  -0.9793052979   2.6631152038
H   -0.3406861122  -1.0513561370   2.3444055256
H   -3.0113503281  -3.6674824350   0.2741562304
H   -3.6573760800  -2.1911609514   0.9775562000
H   -2.7137329874   0.0892262895  -1.3328502661
H   -1.3009331958  -0.1889153468  -2.3483836450
H   -2.9761463417  -3.0131528584   3.2595936264
H   -2.3283267934  -4.4662449219   2.5334431543
H    0.7435015136  -2.1061073837  -1.4819213622
H   -4.6210595445  -5.0710352761   1.6956642792
H   -4.6093047240  -4.8754753689   3.4446896484
H   -5.2695160903  -3.6041000097   2.4222028655
H    3.2391898303   1.5640458488   0.6333569451
H    3.1646804191  -2.0134197788  -1.7244549911
H   -2.9498831318   2.4437302540  -0.2437929483
H    0.2636998524   4.1746270005  -2.1825902687
*