! 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  -5.6840119271  -0.1367222668   0.2353909669
O    1.9665979714  -2.3430496455  -0.8664267763
O    0.0421309254  -0.5707312661  -0.9294454859
N    1.2243956012   1.1098707676   0.1543496495
N    1.1059464909   1.7173583860   1.3405717699
N    1.6271498945   3.2032781343  -0.2573794016
C    3.5913203517  -0.9525875059   0.3337478648
C    2.3221230386  -1.0162841395  -0.5548682524
C    1.0606198483  -0.3201639710   0.0013938922
C    4.6688188879  -1.8036045174  -0.3499926433
C    4.1478954937   0.4696298175   0.4516540976
C    3.3311293378  -1.5068313292   1.7357268975
C    1.5330709033   2.0081909760  -0.7848555137
C   -1.2635302484  -0.4398276097  -0.5760471738
C    1.3599824241   2.9647729021   1.0424406947
C   -1.7133592681   0.0145392621   0.6577258073
C   -2.1845714429  -0.8014200091  -1.5566506192
C   -3.0778297206   0.1031832937   0.9040876533
C   -3.5416136016  -0.7117981737  -1.3104123456
C   -3.9831802634  -0.2573329145  -0.0760415835
H    2.5676987775  -0.5444028339  -1.5136848730
H    0.8087121199  -0.7137528205   0.9905167220
H    4.4120753328  -2.8613498590  -0.3889158411
H    4.8560386918  -1.4648310304  -1.3717181207
H    5.6082676560  -1.7183044883   0.1987610321
H    3.5600627837   1.1133744116   1.1033018187
H    4.2424996901   0.9532149935  -0.5228857767
H    5.1481416380   0.4280565082   0.8866864949
H    4.2607373788  -1.5247197269   2.3067283751
H    2.9572869343  -2.5337302836   1.7250741338
H    2.6223927168  -0.8998937527   2.3017537403
H    1.8971009235  -2.8541530542  -0.0518966104
H    1.6736803892   1.7609897804  -1.8249982155
H    1.3458820936   3.7379985989   1.7939809597
H   -1.0378044313   0.3153945654   1.4456086765
H   -1.8356586183  -1.1574284399  -2.5170491516
H   -3.4175609393   0.4603457858   1.8663137310
H   -4.2457549194  -0.9974892067  -2.0797048029
*