! 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 "1-OCTANOL"
end
*xyz 0 1
Cl   5.0467081686   2.5538729458  -1.7322846720
O   -2.5007427007  -0.1854227901   1.8195805621
N   -1.2860192580  -2.5107572227   0.6274408243
N   -0.2428766796  -2.8008988125  -0.1540616895
N    0.1062389468  -3.5582867489   1.9219774412
C   -2.3864484033  -0.2747337356   0.4131813523
C   -3.6155001622   0.4200807041  -0.2732920490
C   -1.0538495402   0.3354157802  -0.0917855652
C   -2.4317971946  -1.7841307938   0.1297827624
C   -4.9223455549  -0.3097094188   0.0609267944
C   -3.7545855224   1.8607805969   0.2362584875
C   -3.4574590991   0.4601883542  -1.7963963698
C    0.0916136972   0.3927256418   0.9264886336
C    1.3388267013   0.9300995607   0.2818663136
C   -1.0643762291  -2.9669643916   1.8617693773
C    1.5755025965   2.3007905171   0.2150912611
C    2.2715872357   0.0745844457  -0.2983604991
C    0.5677664594  -3.4267641612   0.6634915183
C    2.7078652181   2.8094974018  -0.4036343179
C    3.4126968752   0.5619873533  -0.9176188253
C    3.6210885014   1.9310496547  -0.9645719497
H   -1.2192634819   1.3570263089  -0.4401583740
H   -0.7195772823  -0.2153853878  -0.9744114697
H   -3.3145143612  -2.2245632127   0.5912679515
H   -2.4873616582  -1.9795748929  -0.9385621392
H   -5.7743840553   0.2929151573  -0.2572205169
H   -5.0326516205  -0.4841910116   1.1318975223
H   -5.0136573898  -1.2690979905  -0.4495678554
H   -2.8507145779   2.4576152418   0.1026387959
H   -4.0366255651   1.9068878150   1.2901356163
H   -4.5469657009   2.3688021867  -0.3156292465
H   -3.3318599843  -0.5311358090  -2.2352147995
H   -4.3527282382   0.8916003044  -2.2490109463
H   -2.6138600740   1.0721370968  -2.1178214651
H    0.3010681481  -0.5859637208   1.3576327470
H   -0.1801052029   1.0427536007   1.7612316202
H   -2.4054575742   0.7324209628   2.0940039608
H   -1.7727460263  -2.8574870987   2.6673797545
H    0.8681033382   2.9925779856   0.6578944286
H    2.1093878306  -0.9959448390  -0.2673685402
H    1.5217328239  -3.8102895442   0.3355198704
H    2.8748222443   3.8776801210  -0.4413066646
H    4.1291916874  -0.1212351404  -1.3541166231
*