%chk=000001546.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001546

0 1
 Cl  -3.670300       3.024900     -0.3782000    
 O    2.334300      4.9000001E-03  0.8855000    
 O    2.661500      -1.597300      -1.656100    
 O    4.844100      0.9318000       1.734300    
 N   8.5699998E-02 -0.2643000      0.1626000    
 N   -1.201700      -2.070000      0.4248000    
 N   -1.633500       1.430400     -0.1128000    
 N   -3.868900      0.4593000      1.3600000E-02
 N   -4.236300      -1.878300      0.3678000    
 C    1.299700      0.5484000      4.8900001E-02
 C    3.056700     -0.2631000      -1.352000    
 C    1.845700      0.6431000      -1.373300    
 C    3.519400     -0.2036000      9.5299996E-02
 C    4.477600      0.9502000      0.3643000    
 C   -1.208200      0.1734000      8.3200000E-02
 C   3.4499999E-02  -1.620100      0.3679000    
 C   -1.988600     -0.9597000      0.2485000    
 C   -3.368300     -0.7845000      0.2085000    
 C   -2.983500       1.474500     -0.1328000    
 H    1.043800       1.541100      0.4368000    
 H    3.822000      3.1300001E-02  -2.076100    
 H    2.168400       1.674700      -1.558600    
 H    1.109800      0.3745000      -2.137800    
 H    3.963200      -1.147000      0.4322000    
 H    4.009100       1.919800      0.1698000    
 H    5.384500      0.8697000     -0.2429000    
 H   0.9223000      -2.228900      0.4700000    
 H    3.454600      -2.156900      -1.597500    
 H    5.296500      8.8500001E-02   1.907100    
 H   -3.865700      -2.807600      0.5135000    
 H   -5.235000      -1.724800      0.3349000    


%chk=000001546-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000001546

0 1
Cl -3.459334 3.139026 1.204730
O 2.158012 0.309842 0.701716
O 2.916449 -1.938926 -1.438628
O 4.462705 1.413308 1.867179
N 0.077035 -0.285689 -0.375133
N -1.297673 -2.126836 -0.336741
N -1.542824 1.439600 0.384035
N -3.763395 0.497370 0.810246
N -4.274373 -1.789680 0.526571
C 1.268904 0.563802 -0.459241
C 3.324378 -0.533940 -1.255253
C 2.144278 0.343647 -1.719351
C 3.496533 -0.153345 0.231601
C 4.495678 0.993865 0.470230
C -1.175605 0.167142 0.057067
C -0.056597 -1.675253 -0.589783
C -2.009253 -0.980224 0.068936
C -3.362126 -0.774382 0.469266
C -2.846028 1.488801 0.743054
H 0.891385 1.596306 -0.365830
H 4.244449 -0.332957 -1.839869
H 2.519680 1.316911 -2.076792
H 1.592584 -0.139355 -2.540059
H 3.762848 -1.018329 0.866929
H 4.266189 1.845164 -0.209065
H 5.530715 0.657759 0.282785
H 0.788655 -2.270159 -0.929349
H 3.631248 -2.540069 -1.109937
H 3.507589 1.543178 2.110215
H -3.991667 -2.735997 0.279983
H -5.227040 -1.586178 0.821891


