! 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   4.9119353771   3.7501373952  -0.6166814177
O   -2.1072329257  -0.8506793620   1.6687379531
N   -1.4390325934  -2.8360567679  -0.1339104600
N   -0.3367139543  -3.2768189186  -0.7471284872
N   -0.8535901022  -4.6147693464   0.9682182605
C   -2.1112595832  -0.4379829556   0.3185893916
C   -3.4233194957   0.3999922714   0.1231722295
C   -0.8671856046   0.4176248577   0.0203798830
C   -2.1780436134  -1.6860723329  -0.6100740062
C   -4.6406079621  -0.3533442844   0.6784561108
C   -3.3382722308   1.7325856330   0.8764314025
C   -3.6754086804   0.6995818256  -1.3584956299
C    0.4951967600  -0.2844343681   0.0933607869
C    1.6095974608   0.7108971670  -0.0767131793
C   -1.7393053892  -3.6500758405   0.8825486375
C    2.1192757420   1.4146996014   1.0112963126
C    2.1377538225   0.9776378141  -1.3367743313
C   -0.0174713302  -4.3373810111  -0.0500252136
C    3.1307276966   2.3506872839   0.8559510337
C    3.1488012508   1.9106762313  -1.5140638989
C    3.6394112208   2.5899039582  -0.4108261262
H   -0.8497495190   1.2506649630   0.7260469317
H   -0.9627967005   0.8603542954  -0.9732823581
H   -3.2094665140  -2.0097398585  -0.7365802102
H   -1.7966375970  -1.4561184241  -1.6028517434
H   -5.5403143247   0.2421735270   0.5101805451
H   -4.5645883535  -0.5272734163   1.7518397539
H   -4.8161694454  -1.3176146325   0.1971831995
H   -2.6139598827   2.4213908587   0.4411689653
H   -3.0848825552   1.5924140393   1.9281988401
H   -4.3067203339   2.2352318209   0.8410880348
H   -2.8541390125   1.2475192563  -1.8235274717
H   -3.8532743847  -0.1989509562  -1.9519885971
H   -4.5668258241   1.3217673031  -1.4601821502
H    0.5799072476  -1.0481078187  -0.6786336177
H    0.6281618105  -0.7972497997   1.0510033040
H   -1.2044934852  -1.0079380468   1.9614498726
H   -2.6022571516  -3.5149933940   1.5141301777
H    1.7298976339   1.2295727917   2.0055342835
H    1.7615781273   0.4453398253  -2.2023990803
H    0.8471680262  -4.9366357234  -0.2901036821
H    3.5188029195   2.8813215458   1.7151236179
H    3.5496090343   2.0981946183  -2.5012350090
*