! 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   1.1941756516   0.2557852020  -2.9371943612
Cl   2.1499032770  -4.1502688782  -0.1037819985
O   -1.5843178819   1.3159702703   0.4524566950
O   -1.2010609163   1.4855194197  -1.7351834663
N    1.2430780184   2.0740912775   0.9025364723
N    2.4315816333   1.4697228030   0.8136744614
N    1.8076836778   1.6615670158   2.9599999077
C   -0.5749302107   1.2327451389  -0.5153571080
C   -2.8428038143   1.0206990306  -0.1660294438
C   -2.4735088395   0.8725135557  -1.6443279067
C   -3.4972684265  -0.2192412989   0.4109716376
C    0.4493482678   2.3464603850  -0.2672744189
C    0.0908428980  -0.1426966458  -0.4656107720
C   -3.8442965120  -0.1369493027   1.8935537058
C    0.8961191982  -0.6406863596  -1.4873324290
C   -0.0295052230  -0.9197160963   0.6829223113
C   -4.9375418589   0.8712207587   2.2178624210
C    1.5256583091  -1.8727341847  -1.3886794011
C    0.5953649306  -2.1472175752   0.8147031459
C    0.8805301233   2.1669706035   2.1842339804
C    1.3660941265  -2.6164511284  -0.2333601603
C    2.7281712494   1.2487422992   2.0665851618
H   -3.4862565466   1.8929898577  -0.0202902682
H   -2.4244954925  -0.1809793805  -1.9449500297
H   -3.1615555075   1.3886703423  -2.3114503281
H   -2.8499831008  -1.0820212607   0.2295158065
H   -4.4105066095  -0.4006752013  -0.1661002588
H   -0.0699143697   3.2961739041  -0.1408949768
H    1.1243917444   2.4406568663  -1.1145543216
H   -2.9457243767   0.0906747249   2.4731966240
H   -4.1676120583  -1.1271023624   2.2219681136
H   -0.6275976559  -0.5591933015   1.5075983396
H   -4.6545168078   1.8915858815   1.9545730016
H   -5.8597313097   0.6376890593   1.6820304735
H   -5.1681057233   0.8678958908   3.2838347309
H    2.1372647784  -2.2394568701  -2.2012304636
H    0.4785609645  -2.7231068556   1.7218049624
H   -0.0420924136   2.6233321247   2.5045917627
H    3.6533131569   0.7731939872   2.3519104005
*