! 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   3.7883824740  -3.1831184643   1.9316031229
N   -3.3759119520   0.4077568368   0.2391234955
N   -3.7538783548  -0.8494934591   0.4905699863
N   -4.5190565432   0.5337127194   2.0834810135
N   -0.5253076384  -1.7773240696   0.1546974238
C   -1.0160849654   0.6802586638  -0.5931153582
C   -0.6457380711   1.6664977070   0.5394712627
C   -2.5403108176   0.7393879384  -0.8859695273
C   -0.3077297711   1.0082485344  -1.9031120536
C    0.8488214902   1.9255696061   0.7356376267
C    1.6355974725   0.6862186810   1.0522537824
C   -0.7088991186  -0.6889309775  -0.1709084592
C   -0.3732119133   2.3112208311  -2.3946812312
C    0.3706928873   0.0474758125  -2.6440748125
C    2.4967491582   0.1223595897   0.1173537660
C    1.4770106810   0.0437734540   2.2778681800
C    0.2329326881   2.6445904565  -3.5959763988
C    0.9792273674   0.3819806716  -3.8469162127
C   -3.8378012498   1.2151817808   1.1973270139
C    0.9138512067   1.6803402890  -4.3270723090
C    3.1643609186  -1.0655336060   0.3776435370
C    2.1344583413  -1.1417882168   2.5575903518
C   -4.4322185872  -0.7200791316   1.5995422918
C    2.9679580322  -1.6919354027   1.5956124851
H   -1.0768354540   1.3088735834   1.4773456374
H   -1.1325445520   2.6206817058   0.3271421263
H   -2.7906339442   1.7488659952  -1.2069617439
H   -2.7883828562   0.0628865533  -1.7007569892
H    0.9411013056   2.6435985527   1.5532745969
H    1.2618468908   2.4120490349  -0.1489399661
H   -0.8920680903   3.0848530120  -1.8419688028
H    0.4406207594  -0.9735987199  -2.2926617182
H    2.6477477521   0.6081670432  -0.8384812829
H    0.8207052922   0.4673448758   3.0289713093
H    0.1730988623   3.6620247086  -3.9587176256
H    1.5062499695  -0.3799501154  -4.4056821873
H   -3.6707916881   2.2807773045   1.1992670971
H    1.3893608730   1.9408707430  -5.2632227141
H    3.8260216002  -1.4924183417  -0.3638025195
H    1.9971466023  -1.6303040291   3.5126794746
H   -4.8932331483  -1.5690902113   2.0789694692
*