! 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   5.3387294982   2.3773456017   0.1037589397
O   -2.6245239817  -0.8298721527   1.7783679930
N   -1.2477910161  -2.5632862067  -0.1619531489
N   -1.0862640769  -3.0826003113   1.0605126623
N    0.6078379983  -3.6939306488  -0.2689237348
C   -2.3601396597  -0.4212958483   0.4458489086
C   -3.5511574682   0.5120346805   0.0390056493
C   -0.9771076360   0.2634007421   0.4629953781
C   -2.3363562500  -1.6597429691  -0.4741161134
C   -3.3943319791   1.8915080247   0.6859643081
C   -3.6671716706   0.6948952807  -1.4799697770
C   -4.8852216045  -0.0791191791   0.5177614155
C   -0.3964869061   0.8082468430  -0.8449949971
C    1.0379745371   1.2112850746  -0.6477555329
C   -0.2272328026  -2.9284907382  -0.9346183331
C    1.3742611646   2.5169224444  -0.3028524660
C    2.0628845230   0.2741003176  -0.7530242531
C    0.0372026908  -3.7473553384   0.9452346842
C    2.6915682521   2.8853673688  -0.0696479232
C    3.3854705751   0.6210347247  -0.5248627521
C    3.6879041164   1.9297168044  -0.1827407857
H   -0.2593694893  -0.4561565517   0.8718614675
H   -1.0060848829   1.0730448492   1.1952407374
H   -3.2760090874  -2.2082204820  -0.4043665573
H   -2.2019461827  -1.3808116495  -1.5164079751
H   -2.5655644296   2.4616556609   0.2628542347
H   -3.2434480130   1.8269944303   1.7644722896
H   -4.2996180301   2.4787666797   0.5196662570
H   -4.4167301883   1.4591049110  -1.6935132200
H   -3.9984220768  -0.2153161577  -1.9827455444
H   -2.7429074662   1.0178646881  -1.9559465800
H   -5.7061994913   0.5231822347   0.1232287877
H   -5.0466648620  -1.0997441717   0.1659317209
H   -4.9796395435  -0.0797933566   1.6022376910
H   -0.9664262154   1.6732237809  -1.1863138005
H   -0.4558218651   0.0640473529  -1.6431678216
H   -2.0226969514  -1.5565190173   1.9989741752
H   -0.1439849369  -2.6402697642  -1.9706807610
H    0.5983090981   3.2678197915  -0.2153155595
H    1.8330294984  -0.7501451480  -1.0223361377
H    0.4561451038  -4.2948134633   1.7746158081
H    2.9328709167   3.9058723851   0.1946601857
H    4.1667344854  -0.1211790669  -0.6156940671
*
