! 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  -0.1898872857   1.0483352290   2.8144566278
Cl   4.0972985315   1.4241627595  -0.3542637746
N   -1.2555734292  -2.3301872707  -0.2537751084
N    0.0205482599  -2.7070947844  -0.1462843199
N   -0.8591379655  -3.4674178737  -2.0655060507
C   -1.7422573861   0.0522241826   0.3312118044
C   -2.6214875312   0.4290761335  -0.8625933830
C   -1.8656827398  -1.4332823631   0.7026884138
C   -0.2936408234   0.4399920361   0.1659322264
C   -2.6202832526   1.9175278758  -1.2005690386
C    0.4934683607   0.8778357384   1.2280490187
C    0.3429661951   0.3179154096  -1.0678816890
C   -3.0393197434   2.8168725388  -0.0474648530
C    1.8384735945   1.1869135605   1.0869396573
C    1.6823248389   0.6136539992  -1.2471978140
C   -1.7611003401  -2.7859649398  -1.4007951293
C    2.4207777733   1.0479640262  -0.1596515381
C    0.2085033947  -3.3824431405  -1.2499082605
H   -2.1477800303   0.5724236632   1.2010859506
H   -2.3426866752  -0.1353891481  -1.7564053234
H   -3.6435724357   0.1201911613  -0.6237922587
H   -2.9191401309  -1.6974364691   0.7942504871
H   -1.4010860583  -1.6266233918   1.6678503437
H   -1.6338798834   2.2221088891  -1.5598485454
H   -3.3010069957   2.0705138196  -2.0408236636
H   -0.2195133006  -0.0225837669  -1.9277447392
H   -4.0100222596   2.5212607317   0.3553048548
H   -3.1212323893   3.8544692964  -0.3725479119
H   -2.3229256307   2.7984172552   0.7757567143
H    2.4162517130   1.5270415258   1.9350285397
H    2.1387128371   0.5025832502  -2.2208190495
H   -2.7840701000  -2.6223938493  -1.7007289552
H    1.1579926809  -3.8424301532  -1.4743663804
*