! 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   3.4708644512   1.5874957011  -0.0017221431
O   -2.6462379318  -1.5633351305  -0.0000146492
N   -1.4114875159   0.3511303111   0.0044836587
N   -3.7085319303   0.4429388314   0.0005138170
C   -0.1172186959  -0.1623355501   0.0031281050
C    2.6078749319  -0.9765763032   0.0000287692
C    0.9180866581   0.7767798472   0.0019632645
C    0.2223687203  -1.5157661486   0.0029046029
C    2.2370424115   0.3652655878   0.0003545203
C    1.5578434531  -1.8882138918   0.0014062203
C   -2.5999054642  -0.3385681799   0.0014979818
C    4.0357506504  -1.4238084180  -0.0019595831
C   -5.0217254240  -0.1635063635  -0.0054428528
C   -3.6585824934   1.8904313540   0.0017042168
H    0.6896597844   1.8357384929   0.0023486518
H   -0.5333107137  -2.2818683310   0.0037214572
H   -1.4508693253   1.3574546906   0.0036716450
H    1.7912365538  -2.9461394903   0.0009376238
H    4.5775262095  -1.0629271410   0.8739748176
H    4.0952842915  -2.5113516381  -0.0003697750
H    4.5741381434  -1.0657760216  -0.8811656010
H   -4.9437960542  -1.2453692981  -0.0097240381
H   -5.5843222366   0.1405345221  -0.8904402360
H   -5.5892814599   0.1330474812   0.8789626523
H   -3.1693145331   2.2929157666  -0.8889627784
H   -3.1648830393   2.2908339782   0.8907082889
H   -4.6747028682   2.2760939493   0.0049497402
*