! 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   0.6791230531  -1.3370972186  -2.2927824998
Cl   4.8435030368   0.9278724118   0.1383104289
O   -1.4636237722  -1.4790592244  -0.2646099270
O   -1.6527675222   0.1019486527   1.2838476625
N   -1.2631654940   2.1056211890  -0.8987898616
N   -0.2658062883   2.5382004681  -1.6767837416
N   -0.7396239375   4.0548340998  -0.0924072388
C   -1.1024847093  -0.1641251334   0.0266915552
C   -1.5998154407  -2.2002443483   0.9604370866
C   -1.5215281041  -1.0990923751   2.0288512813
C   -2.9054743329  -2.9723259363   0.9513398059
C   -1.7654422543   0.7596946212  -1.0014052564
C    0.4121677712   0.0406849453   0.0530346097
C   -3.0369930255  -3.9014051490   2.1520273631
C    1.2663898121  -0.4299495272  -0.9405197930
C    0.9778808405   0.8123181150   1.0640086137
C   -4.3375260651  -4.6892176342   2.1327866238
C    2.6283516637  -0.1698617292  -0.9193796179
C    2.3318774900   1.0950036336   1.1079176741
C   -1.5209011465   3.0121996424   0.0464504169
C    3.1481495785   0.5932057876   0.1107609517
C    0.0074097276   3.7055614087  -1.1576101697
H   -0.7603630889  -2.8954860126   1.0650649174
H   -2.3334658361  -1.1390110331   2.7548978163
H   -0.5729573427  -1.1288906665   2.5724145246
H   -2.9621972577  -3.5646303903   0.0333545607
H   -3.7439748122  -2.2681825263   0.9295060736
H   -2.8441052852   0.7600606179  -0.8448519527
H   -1.5724801640   0.4079149745  -2.0117413570
H   -2.9804897659  -3.3258107279   3.0806701501
H   -2.1894533589  -4.5924308209   2.1710929892
H    0.3480675004   1.2146014059   1.8450363052
H   -4.4169831768  -5.3011782953   1.2325019061
H   -4.4101547722  -5.3565893933   2.9920572697
H   -5.2037902322  -4.0257693651   2.1572623948
H    3.2691899713  -0.5518397246  -1.7015886794
H    2.7353495149   1.6978930103   1.9090000750
H   -2.2875169519   2.8841318129   0.7936733541
H    0.7760962450   4.3389954642  -1.5715167139
*