! 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  -1.3778092761   1.1787448148   0.7487879101
Cl  -4.3643896768  -3.2414396649   0.4939291609
O    3.0940595221  -0.6302252068  -0.3760260719
N    1.9108509509  -1.1944944694  -0.0255820583
N    2.3719743144   3.1055361452   1.2939258847
C    0.9994425077   0.7015995854  -1.2982787377
C    0.9036564270  -0.5385919150  -0.4541931558
C   -0.4047164766  -1.1760888683  -0.1915449500
C    1.5641298534   1.9360057724  -0.6418934457
C   -1.5069212351  -0.4898725648   0.3164847562
C   -0.5695490095  -2.5344607617  -0.4630276065
C    1.7422648614   3.0861557296  -1.4019439019
C    1.9002648146   2.0127419082   0.7042015167
C   -2.7263655694  -1.1119534685   0.5296077370
C   -1.7730796073  -3.1837477554  -0.2540846741
C   -2.8462567731  -2.4593848937   0.2369287191
C    2.2305351344   4.2340273648  -0.8009528381
C    2.5302344948   4.1941492634   0.5504288497
C    4.1743706464  -1.3872677363   0.1405917933
H    1.6211582928   0.4584988377  -2.1661814829
H    0.0162523898   0.9372579367  -1.7067591779
H    0.2630927407  -3.0937667225  -0.8660141134
H    1.4971827236   3.0849943211  -2.4573367795
H    1.7759762178   1.1536782704   1.3524387807
H   -3.5621774520  -0.5542246721   0.9277687427
H   -1.8694979657  -4.2357671074  -0.4820079723
H    2.3748932605   5.1437069121  -1.3670797882
H    2.9128765231   5.0747711180   1.0526664160
H    4.1506901237  -1.4342593485   1.2305765283
H    5.0800059915  -0.8716914970  -0.1712508283
H    4.1867090518  -2.4012673698  -0.2634254218
*
