! 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   2.1901621871  -2.6392278282  -1.7377532468
Cl   0.8080002385   1.3562180124   1.5631547924
Cl   5.9816773868   0.4429333566   0.4888755782
O    0.3390021072  -0.8977590230  -0.2904873923
O   -2.7630942755  -0.7150979153  -1.9528553649
N   -2.3821286300  -0.6233995125   0.2906554095
N   -3.1344117871   1.2530827754  -0.8908440716
N   -4.3425380931   3.0260494137  -1.3886211035
C   -2.7579812351  -0.0740104801   1.5934037115
C   -1.7204028998  -1.9182029701   0.3156103760
C   -4.0440021222  -0.6768660125   2.1427507013
C   -0.2537294026  -1.7905579112   0.6562878991
C   -2.7441098753  -0.1159539729  -0.8942745378
C   -5.2763596196  -0.3896357848   1.3010498046
C    1.6353525319  -0.6081228084  -0.0785402448
C   -2.4360092057   2.3421913211  -0.4218564268
C   -4.2663143274   1.7297075441  -1.4721503246
C    2.6424019617  -1.3336485479  -0.7111869484
C    2.0231139978   0.4394038843   0.7535222360
C   -3.1973424804   3.4194545930  -0.7439890957
C    3.9814575331  -1.0214462615  -0.5519630611
C    3.3528263099   0.7772433505   0.9362420784
C    4.3176515842   0.0349770781   0.2772299672
H   -1.9369596697  -0.2674825429   2.2841713448
H   -2.8553374064   1.0072125784   1.5403339063
H   -1.8433144918  -2.4141268959  -0.6435633375
H   -2.1893345177  -2.5597618640   1.0632824778
H   -4.1796824863  -0.2618694664   3.1441318367
H   -3.9268341842  -1.7550876095   2.2777293901
H   -0.1093074942  -1.4156687146   1.6732816845
H    0.2088619778  -2.7799681207   0.6006664490
H   -6.1679558064  -0.7936034266   1.7811694043
H   -5.4341455553   0.6826257509   1.1706361719
H   -5.2199242158  -0.8464402009   0.3115697703
H   -1.4690643199   2.2602645094   0.0437803905
H   -5.0008980576   1.0805207885  -1.9211031595
H   -2.9768784099   4.4569735793  -0.5526190797
H    4.7429438158  -1.5949660775  -1.0606896540
H    3.6261409426   1.5999494701   1.5814175392
*