! 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   1.8605811032   2.4230938689   0.7937902862
Cl   5.4779810082  -1.2807314668  -0.4631625619
O   -1.1493507303  -0.8246142289  -0.1142657376
O   -0.6062948793   0.8523267879   1.2849399260
N   -2.0958818110   1.6284465553  -1.0622399720
N   -2.5335946182   2.6671526358  -0.3437598252
N   -4.2626776535   1.5164056939  -1.1956988810
C   -0.3365971563   0.2999107859   0.0229156432
C   -1.6491088930  -1.2007484378   1.1675952590
C   -1.6702578076   0.1346480266   1.8859388720
C   -3.0003713332  -1.8622386704   1.0314149680
C   -0.7053044055   1.2660066611  -1.1144166264
C    1.1402319681  -0.0699934338  -0.0738295912
C   -2.9698639806  -3.2029519155   0.3093506765
C    2.1731205313   0.8106983521   0.2447939444
C    1.5008838178  -1.3342857838  -0.5291296812
C   -4.3478824507  -3.8431811380   0.2418397794
C    3.5065894274   0.4484871979   0.1285227446
C    2.8239936713  -1.7243766923  -0.6519740563
C   -3.1356545602   0.9478442548  -1.5479164528
C    3.8186148271  -0.8233744137  -0.3183157170
C   -3.8313148848   2.5571493636  -0.4572990265
H   -0.9409101539  -1.8853048894   1.6526747430
H   -2.6250546231   0.6562276878   1.7459679114
H   -1.4822502342   0.0417597003   2.9553957701
H   -3.6861517132  -1.1767291495   0.5228495516
H   -3.3978731803  -2.0029353691   2.0413862586
H   -0.5042170975   0.7892450604  -2.0731046674
H   -0.1128645721   2.1760261788  -1.0681235993
H   -2.2762700033  -3.8758073119   0.8218248338
H   -2.5802527713  -3.0712750918  -0.7030346985
H    0.7305436256  -2.0429762969  -0.7967705992
H   -5.0580986719  -3.1996227163  -0.2809086348
H   -4.3200175817  -4.7970492562  -0.2856804566
H   -4.7480018693  -4.0301379591   1.2400872203
H    4.2867873188   1.1518130005   0.3843341649
H    3.0670239526  -2.7171725515  -1.0035578190
H   -3.0278006381   0.0715796332  -2.1663898434
H   -4.4995739782   3.2657800683   0.0062641099
*