! 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  -0.1505661296  -2.2060836575  -2.1259227183
Cl  -4.5676791139  -2.1368223925   0.9029180361
O    3.1606758557  -0.1998909158   0.6107238341
N    1.9231905554  -0.7133513140   0.8399495848
N    0.3819124827   3.9428205766   0.1653641167
C    1.3535362084   0.5718477885  -1.1925552864
C    1.0722984084  -0.3595909139  -0.0403759350
C   -0.3107954308  -0.8277796836   0.1936641423
C    1.4844597596   1.9889189947  -0.6955920619
C   -0.9790616042  -1.6431376842  -0.7160431169
C   -0.9960349855  -0.4424994083   1.3425528585
C    2.7093392064   2.6369383918  -0.6065503926
C    0.3565831460   2.6987690598  -0.2958588090
C   -2.2857571519  -2.0524699062  -0.5133388731
C   -2.3024983091  -0.8385617716   1.5751880687
C   -2.9359792698  -1.6364847395   0.6373591895
C    2.7502072762   3.9393415371  -0.1346444501
C    1.5639264845   4.5455464384   0.2434466959
C    4.0524124729  -0.5765756414   1.6442095166
H    2.2615647058   0.2716847605  -1.7171074362
H    0.5377100831   0.5179158067  -1.9127594857
H   -0.5000328252   0.1910267823   2.0653863733
H    3.6184988999   2.1356740323  -0.9118533122
H   -0.6237821560   2.2372811350  -0.3635104233
H   -2.7810273605  -2.6894125363  -1.2325358035
H   -2.8155659161  -0.5219751240   2.4721432129
H    3.6850335741   4.4772507396  -0.0594517241
H    1.5656369617   5.5627346922   0.6167338616
H    5.0127095923  -0.1328744443   1.3900531128
H    4.1685598176  -1.6604353517   1.7065927337
H    3.7317984126  -0.1926912942   2.6145634167
*
