! 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   0.9001925098   0.6869388315   1.7024111057
Cl  -6.7738440369  -1.5094593951   1.2789964722
O    3.4998779356  -0.3244047407   0.9134507620
O    4.0191348218  -0.8417910876  -1.1835442872
O   -2.1541975427  -0.4388366987  -2.1604745458
N    3.1596391729   2.4603863916   0.1027734881
N    2.0693567198   3.1062050888  -0.3195562488
N    2.6215792547   3.7662489873   1.7535447319
C    3.2473425946   0.0358545285  -0.4092352704
C    3.7842165805  -1.7251691092   0.9558042865
C    3.8000811887   1.4380473109  -0.6796788747
C    3.9498999285  -2.0951670892  -0.5246272968
C    1.7697240578  -0.0850702022  -0.7852824529
C    2.7022004313  -2.5149064516   1.6561819174
C    0.6959715153   0.1744401982   0.0623306384
C    1.4558925883  -0.4415283441  -2.0970475897
C   -0.6215740046   0.0555407302  -0.3605854937
C    0.1558744882  -0.5735967803  -2.5439591934
C   -0.8882534533  -0.3296601238  -1.6642111855
C    3.4659887745   2.8552435136   1.3390018841
C    1.7861326077   3.8688329541   0.7031833048
C   -3.2049201173  -0.6907538385  -1.3115796877
C   -4.3093101505   0.1419931191  -1.3845795713
C   -3.1921504094  -1.7797580244  -0.4503986870
C   -5.4175200700  -0.1144878447  -0.5911508897
C   -4.2930491368  -2.0295869713   0.3520969031
C   -5.3975436046  -1.1941940567   0.2762908125
H    4.7278929182  -1.8432344535   1.4936470723
H    3.6803040609   1.6875406004  -1.7325869016
H    4.8657588870   1.4475437058  -0.4502750787
H    4.8659083792  -2.6475480119  -0.7276841591
H    3.1010402859  -2.6848462544  -0.8892301618
H    1.7424606481  -2.4330121601   1.1444955798
H    2.5742344568  -2.1880875052   2.6874907401
H    2.9809275667  -3.5696941623   1.6762260040
H    2.2556819865  -0.6375179502  -2.7976964549
H   -1.4221739521   0.2762171064   0.3323435773
H   -0.0458096304  -0.8624951061  -3.5667495176
H    4.3151550167   2.4740700681   1.8829548386
H    0.9432133681   4.5416482251   0.6851323583
H   -4.3122878527   0.9857081904  -2.0618460444
H   -2.3352415239  -2.4390165775  -0.3985023443
H   -6.2821900466   0.5318069855  -0.6506071839
H   -4.2852698407  -2.8759129053   1.0248221180
*