! 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  -0.7511246027  -0.4764467237   2.4095773636
Cl   1.7021309704  -4.1385440571  -0.5777099232
O   -1.7914485159   1.5169945828   0.4182307256
O   -0.4882409316   2.0941704971  -1.2986321084
N    1.7836863524   2.2360741064   0.5279643026
N    2.6038295631   1.3691329170   1.1292154564
N    3.6288721388   2.3377056085  -0.6157761107
C   -0.4760755819   1.4785283472  -0.0408268653
C   -2.6568356185   1.4320591853  -0.7133946864
C   -1.7987939034   2.0156216159  -1.8425433428
C   -3.1432476913   0.0223139125  -1.0062147549
C    0.3928018254   2.3329781290   0.8914415856
C    0.0606207134   0.0515490736  -0.1505420698
C   -3.9122462516  -0.6302827257   0.1323647073
C   -0.0330766983  -0.8763624634   0.8843616268
C    0.7132512247  -0.3551806682  -1.3093952014
C   -4.4008730212  -2.0213852847  -0.2391477966
C    0.4621356496  -2.1648535496   0.7622253670
C    1.2255158026  -1.6331221885  -1.4583508063
C    2.4042836285   2.7924790337  -0.5141073600
C    1.0860951293  -2.5319511584  -0.4170625967
C    3.6913961460   1.4712482279   0.4132084774
H   -3.5155583462   2.0708782237  -0.4962239946
H   -1.8073150100   1.3818688834  -2.7326740714
H   -2.1177273535   3.0173993989  -2.1313168377
H   -2.3055333722  -0.6168167776  -1.3030669144
H   -3.7910360565   0.0941356041  -1.8865011259
H    0.2950223465   2.0153919999   1.9259349024
H    0.0733802455   3.3728616778   0.8267318879
H   -4.7643077457  -0.0016386308   0.4069404191
H   -3.2785919556  -0.6941607698   1.0187008537
H    0.8267457365   0.3386008282  -2.1299415768
H   -5.0762832413  -1.9917571678  -1.0960143108
H   -3.5668433013  -2.6747010701  -0.5023250120
H   -4.9366763456  -2.4910550522   0.5864029390
H    0.3666512054  -2.8664768453   1.5791245206
H    1.7231863778  -1.9153940783  -2.3751852310
H    1.9430350704   3.5295273606  -1.1509487388
H    4.5746314904   0.8978317224   0.6461283939
*