! 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   0.1770765101  -0.9770163067   2.2554658042
Cl   0.3172433964  -5.2261011650  -0.9533563299
O   -0.5755689048   1.2467779680   0.4684384782
O    0.3117252140   1.3957573889  -1.5806539608
N    1.8461886586   2.6563263043   0.4784016593
N    1.5601765091   3.1582350141   1.6827812617
N    1.8366172391   4.8107281850   0.1896850415
C    0.4741982350   0.7884977765  -0.3323186995
C   -1.5680710788   1.8739747301  -0.3432188195
C   -1.0783928364   1.6030141663  -1.7593048548
C   -2.9613280328   1.3566876469  -0.0332424907
C    1.8278288860   1.2406025956   0.2236826952
C    0.4421904384  -0.7342268251  -0.4560883539
C   -3.1245373803  -0.1587706622  -0.0335854954
C    0.3004337351  -1.5847709343   0.6387901455
C    0.5703178187  -1.3280865192  -1.7077176660
C   -4.5786074055  -0.5672073609   0.1503975970
C    0.2610667429  -2.9632958315   0.4971015587
C    0.5328526332  -2.7016920774  -1.8807437695
C    1.9939873444   3.6502744322  -0.3979115151
C    0.3728972203  -3.5090221463  -0.7694532596
C    1.5725488601   4.4447957462   1.4576554741
H   -1.5394308546   2.9512758555  -0.1453794041
H   -1.5531058230   0.7250676294  -2.2106575432
H   -1.2237128883   2.4515541513  -2.4254488476
H   -3.6378735321   1.8052645397  -0.7686824879
H   -3.2773060407   1.7503711266   0.9367188346
H    2.6098870951   0.9943885184  -0.4940057579
H    2.0656038255   0.7301884567   1.1533377299
H   -2.5217144961  -0.5921315209   0.7666583407
H   -2.7496869143  -0.5904622855  -0.9655374157
H    0.6999233699  -0.7072374796  -2.5827877624
H   -4.6861149388  -1.6522123153   0.1711441500
H   -4.9867985080  -0.1794286867   1.0857638278
H   -5.2035763260  -0.1902838030  -0.6612801320
H    0.1452244636  -3.5975674201   1.3648306867
H    0.6278089883  -3.1266193054  -2.8699078214
H    2.2390411893   3.4897227300  -1.4351019636
H    1.3874874838   5.1547223917   2.2483597313
*