! 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   0.8723323244   0.0181403275   2.1534824723
Cl   4.2056398282  -2.1903852457  -1.3418762606
O   -2.1681574895  -0.4190558582  -1.1493422640
O   -1.7814693146  -0.0582823893   1.0116394164
N   -0.4078366121   2.4319455803   0.3066270068
N    0.8792548517   2.6431330905   0.0177732604
N    0.3670292854   3.5210218445   2.0188822261
C   -1.2617557933   0.1701992705  -0.2570778947
C   -2.8933881567  -1.4457994649  -0.4633306648
C   -2.3385806622  -1.3600572204   0.9611608205
C   -1.2743970282   1.6721301496  -0.5534524225
C    0.1286789752  -0.4421307646  -0.4514885941
C   -4.3830251937  -1.1793601085  -0.5580764723
C   -4.8988191099  -1.1238190648  -1.9871592964
C    1.1104863955  -0.5359579789   0.5329031282
C    0.4653929647  -0.8973859869  -1.7247722363
C    2.3613062290  -1.0773030040   0.2655910939
C    1.7061354619  -1.4317623880  -2.0211356346
C   -0.6914561733   2.9491791423   1.5024290184
C    2.6475659563  -1.5205600771  -1.0112408042
C    1.2960579131   3.2934168072   1.0718834853
H   -2.6574714189  -2.4130215116  -0.9174477735
H   -3.1060959137  -1.4401991826   1.7301412903
H   -1.5783745241  -2.1252524627   1.1497737572
H   -2.2915789383   2.0436506298  -0.4297892290
H   -0.9758467459   1.8475638325  -1.5854179146
H   -4.6198547390  -0.2491599352  -0.0325052413
H   -4.8928474559  -1.9802331157  -0.0164844186
H   -4.4508262872  -0.3044946172  -2.5492742261
H   -4.6867986564  -2.0511699000  -2.5226825941
H   -5.9788284643  -0.9770509385  -2.0029062231
H   -0.2635274715  -0.8358707776  -2.5201175558
H    3.1015933952  -1.1440969131   1.0501960138
H    1.9263695096  -1.7737944830  -3.0222096721
H   -1.6745460748   2.9047444481   1.9427557351
H    2.3172807052   3.6297158468   1.1566414932
*