! 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   1.8097493035   1.9812636975   1.7015686400
Cl   4.1208799917  -0.8700405069  -2.1572875461
O   -1.8087982955  -0.5646644905   0.8400038946
O   -0.6465340854   0.5042204029   2.4240139827
N   -1.4865639462   1.8024652657  -0.8921636438
N   -0.5190923340   2.3751403050  -1.6144149275
N   -1.9684784186   1.3051994642  -2.9523553644
C   -0.8479739263   0.4228535777   1.0378102001
C   -1.6127743959  -1.5401180155   1.8620061285
C   -1.1575357728  -0.6753043988   3.0320518970
C   -2.8953625398  -2.3022306559   2.1034167575
C   -1.4248021064   1.7565386917   0.5467425484
C    0.4419621634   0.0784198464   0.2934385910
C   -3.3582575964  -3.1569039664   0.9266786322
C    1.6512865512   0.7327948645   0.5128577938
C    0.4099978875  -0.8697008289  -0.7250186205
C   -2.4089126056  -4.2944573497   0.5786522023
C    2.7862142486   0.4459817158  -0.2300816518
C    1.5256811211  -1.1765946491  -1.4848002548
C   -2.3304496209   1.1595611278  -1.7014968626
C    2.7101032303  -0.5113341328  -1.2256822997
C   -0.8560688654   2.0550798036  -2.8351652881
H   -0.8060455944  -2.2241633713   1.5697692579
H   -1.9884695770  -0.4114702150   3.6930351367
H   -0.3821600252  -1.1623611550   3.6247104526
H   -3.6782066390  -1.5902220303   2.3802254012
H   -2.7377237846  -2.9423386250   2.9768413902
H   -0.8108951246   2.5888812576   0.8806051358
H   -2.4258012646   1.8894021462   0.9572516672
H   -3.5175034621  -2.5256969507   0.0486618184
H   -4.3366724488  -3.5737527771   1.1767771505
H   -0.5136014743  -1.3871602879  -0.9440460774
H   -2.2374553355  -4.9423845802   1.4404483177
H   -2.8167495852  -4.9129897845  -0.2214125561
H   -1.4359901961  -3.9344800982   0.2396448994
H    3.7117195471   0.9700740278  -0.0367020314
H    1.4627250811  -1.9201201889  -2.2665999870
H   -3.1936600504   0.6213604386  -1.3448765408
H   -0.2743530412   2.3807511751  -3.6830258230
*
