%chk=000029984.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029984

0 1
 Cl   3.270300      0.1389000      -2.824000    
 O  -0.5633000     -5.2999999E-02  0.1402000    
 O   0.8354000     -0.4738000       1.900000    
 N   -3.333500     -0.5946000     -0.2891000    
 N    1.635400     -0.1627000     -0.2780000    
 C   -2.871700      0.6956000      0.2010000    
 C   -1.556600      0.5352000      0.9808000    
 C   -2.719700       1.686800     -0.9615000    
 C   -1.050200       1.894900       1.471900    
 C   -2.205700       3.038800     -0.4677000    
 C   -4.629200     -0.5052000     -0.9616000    
 C   -3.531400      -1.563200      0.7890000    
 C  -0.9104000       2.901000      0.3280000    
 C   -5.077700      -1.957500      -1.030800    
 C   -4.359000      -2.652100      0.1219000    
 C   0.6705000     -0.2530000      0.7064000    
 C    3.035300     -0.3025000     -0.1400000    
 C    3.874500     -0.1835000      -1.237900    
 C    3.542500     -0.5631000       1.125000    
 C    5.251400     -0.3283000      -1.067600    
 C    4.919400     -0.7080000       1.295100    
 C    5.773800     -0.5906000      0.1989000    
 H   -3.617100       1.112500      0.8950000    
 H   -1.703200     -0.1018000       1.861200    
 H   -3.676400       1.868300      -1.463500    
 H   -2.030300       1.290600      -1.718300    
 H  -9.0300001E-02   1.825900       1.992400    
 H   -1.765300       2.293700       2.203200    
 H   -2.970200       3.510200      0.1623000    
 H   -2.042900       3.705500      -1.322300    
 H   -4.561900     -8.7300003E-02  -1.970800    
 H   -5.355400      7.8699999E-02 -0.3818000    
 H   -4.092800      -1.135500       1.629600    
 H   -2.595300      -1.987400       1.165100    
 H  -0.1007000       2.590800     -0.3434000    
 H  -0.6262000       3.878600      0.7340000    
 H   -4.778600      -2.413700      -1.981900    
 H   -6.165100      -2.046600     -0.9430000    
 H   -5.065100      -3.106400      0.8244000    
 H   -3.714800      -3.448200     -0.2696000    
 H    1.303100      2.8700000E-02  -1.220000    
 H    2.956900     -0.6689000       2.025400    
 H    5.931000     -0.2400000      -1.911300    
 H    5.327900     -0.9122000       2.280700    
 H    6.845800     -0.7035000      0.3316000    


%chk=000029984-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000029984

0 1
Cl 3.263304 0.890849 -2.474283
O -0.337115 1.494508 0.569119
O 0.319713 -0.389009 1.833816
N -2.516178 -0.378339 0.000162
N 1.468777 0.334862 -0.107795
C -2.761499 1.041348 0.341335
C -1.647285 1.574060 1.286913
C -2.874723 1.949327 -0.907635
C -1.856681 3.048040 1.667248
C -3.114294 3.426551 -0.511830
C -3.334629 -0.945434 -1.107929
C -2.706891 -1.332214 1.131876
C -2.004016 3.955017 0.424188
C -3.042522 -2.464846 -1.036725
C -2.664477 -2.728356 0.459145
C 0.464890 0.382283 0.851283
C 2.542285 -0.576838 -0.181539
C 3.483730 -0.455580 -1.240792
C 2.741719 -1.632217 0.752670
C 4.577112 -1.322540 -1.386916
C 3.837678 -2.507635 0.614523
C 4.759255 -2.363502 -0.447350
H -3.722470 1.145518 0.921519
H -1.562186 0.941893 2.188849
H -3.706036 1.605374 -1.549356
H -1.940224 1.861311 -1.494232
H -1.013996 3.379441 2.301430
H -2.775195 3.109650 2.286225
H -4.096839 3.513872 -0.001830
H -3.173373 4.049829 -1.424635
H -3.050307 -0.507920 -2.079396
H -4.428602 -0.755892 -0.950840
H -3.699352 -1.166765 1.627043
H -1.912561 -1.211022 1.885835
H -1.041401 3.979398 -0.121576
H -2.226599 4.991774 0.740757
H -2.194464 -2.719989 -1.694936
H -3.914433 -3.057006 -1.366095
H -3.360855 -3.429581 0.951496
H -1.650103 -3.155827 0.530090
H 1.406193 1.040291 -0.847859
H 2.026689 -1.741262 1.570618
H 5.272616 -1.184715 -2.219728
H 3.969587 -3.311208 1.346906
H 5.608956 -3.045399 -0.550769


