! 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  -2.7738442820  -0.7050131597  -0.0862272917
O   -0.6427693319   3.1208292280  -0.4286055509
O   -2.4373309696   2.1471299629   0.4762042604
N    0.8268702261   0.9954860440   0.0358635872
N    1.1075287452  -1.3421406143   0.0049176625
N   -0.6625732310  -2.7821483804  -0.0697451550
C    3.0302797596   0.0923002854   0.0658913612
C    3.9308294268  -0.8614751629  -0.6765520609
C    3.9039677414  -0.8870653362   0.8067061576
C    1.5704151467  -0.1004610929   0.0350928291
C   -0.4976596658   0.8307076866   0.0148510949
C   -0.2062180324  -1.5322892211  -0.0275414937
C   -1.0801781138  -0.4134553397  -0.0144432291
C   -1.3114271794   2.0891565309   0.0524883805
H    3.3345217185   1.1301962316   0.0883787749
H    4.7906420754  -0.4304435773  -1.1719820524
H    3.4589761441  -1.6751105724  -1.2112323804
H    3.4127276753  -1.7180734854   1.2951400285
H    4.7453419113  -0.4748117881   1.3475487345
H   -1.6437904453  -2.9951511098  -0.0921650281
H   -0.0084921514  -3.5460466875  -0.0727591196
H   -1.1954754098   3.9168088528  -0.3828501044
*
