! 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   0.4906509628  -1.3171080315  -2.3173414060
Cl   4.7759669416   0.6678749868   0.1478464580
O   -1.6567759926  -1.3638130800  -0.2850249782
O   -1.7583878257   0.2090587661   1.2770180550
N   -1.2840639930   2.2124953128  -0.8779893452
N   -0.2607653004   2.6134689670  -1.6379225460
N   -0.6967139765   4.1311804576  -0.0434876306
C   -1.2246106506  -0.0739223116   0.0160292401
C   -1.7725066204  -2.0963234000   0.9358761836
C   -1.6901371572  -1.0027838013   2.0143034381
C   -3.0794572632  -2.8677589479   0.9301620542
C   -1.8395403737   0.8894411154  -1.0038457999
C    0.2995268728   0.0475015096   0.0435867242
C   -3.2370376809  -3.8038424682   2.1259683191
C    1.1272598415  -0.4621263541  -0.9533604657
C    0.9078750787   0.7734129000   1.0636819719
C   -2.2552818599  -4.9672828192   2.1378407877
C    2.5023180407  -0.2841969430  -0.9265492996
C    2.2763842115   0.9733772583   1.1142365951
C   -1.5189547010   3.1177268088   0.0733124378
C    3.0641578534   0.4342762103   0.1136032282
C    0.0495816293   3.7636151302  -1.1021717427
H   -0.9223876214  -2.7799014450   1.0210912265
H   -2.5261444154  -1.0211429445   2.7139159283
H   -0.7614853932  -1.0678705162   2.5878271199
H   -3.1448263806  -3.4528345498   0.0080610778
H   -3.9076311118  -2.1528908189   0.9125120418
H   -2.9186540998   0.9318297245  -0.8574029327
H   -1.6504756753   0.5439626750  -2.0170752118
H   -4.2552186573  -4.1982635175   2.1142878344
H   -3.1502153065  -3.2397458905   3.0595862456
H    0.3016150273   1.2053373334   1.8474306204
H   -1.2208588417  -4.6388026733   2.2462241471
H   -2.4643506498  -5.6438542820   2.9671029729
H   -2.3211419428  -5.5474202715   1.2155887336
H    3.1211900619  -0.6956718689  -1.7114390328
H    2.7123078887   1.5427328083   1.9227629545
H   -2.3010958879   3.0122318525   0.8077475907
H    0.8477607528   4.3712719135  -1.4982913379
*