! 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  -0.0473462539  -1.1235514358   2.8682181818
Cl  -4.6209547726  -2.1277722531   0.2688988395
O    3.1409376348  -0.5582575825  -0.6312293564
N    1.8869974917  -1.0756444199  -0.5490981451
N    2.7597872523   3.4916830204  -1.6867536301
C    1.4591869360   0.9606012540   0.7859704089
C    1.0988990278  -0.3576859128   0.1485433809
C   -0.3035697789  -0.8246746145   0.1933833098
C    1.4815381696   2.0400910984  -0.2647514214
C   -0.9391537747  -1.1572657031   1.3868405074
C   -1.0419736981  -0.9263957707  -0.9826043215
C    0.3043623043   2.5504785726  -0.8006099303
C    2.6784325929   2.5537189015  -0.7505912163
C   -2.2634526839  -1.5586095879   1.4265679634
C   -2.3672588050  -1.3276607339  -0.9755264248
C   -2.9660815921  -1.6340003587   0.2347762520
C    0.3746557504   3.5251848442  -1.7820448675
C    1.6240817816   3.9604654455  -2.1922324616
C    3.9638163330  -1.3842876871  -1.4352870362
H    0.7221043523   1.2145604112   1.5466844922
H    2.4259221366   0.8968481819   1.2869447738
H   -0.5730522924  -0.6732005092  -1.9237299914
H   -0.6589694786   2.1993499660  -0.4504495333
H    3.6193494339   2.1928411140  -0.3513726136
H   -2.7319288928  -1.8171302998   2.3656698795
H   -2.9205591854  -1.3929147848  -1.9014928558
H   -0.5208437016   3.9456419443  -2.2178852759
H    1.7117422375   4.7227387508  -2.9571608206
H    3.5865761569  -1.4591950154  -2.4569790663
H    4.0666741997  -2.3869012708  -1.0155414547
H    4.9418757629  -0.9083315125  -1.4549063520
*
