%chk=000044976.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044976

0 1
 Cl  -4.843000       2.750300       1.197400    
 O  -0.9349000      0.2964000      0.4464000    
 O  -0.9928000      -1.337400      -1.192700    
 O    4.999600     -0.6152000     -0.7815000    
 N   -2.978600     -0.5374000     -0.2841000    
 N    4.578400      0.1950000      5.4800000E-02
 C   -3.673000      0.3468000      0.6464000    
 C   -3.824200      -1.395200      -1.101900    
 C   0.4601000      0.2707000      0.3473000    
 C    2.554100     -0.6224000       1.053300    
 C    2.464600       1.088800     -0.6498000    
 C   -1.586400     -0.5931000     -0.4132000    
 C    3.204900      0.2203000      0.1524000    
 C    1.163000     -0.5971000       1.152000    
 C    1.073400       1.114400     -0.5510000    
 C   -4.002300       1.697200      3.2800000E-02
 C   -4.090600      -2.722300     -0.4118000    
 C    3.307500      -1.569800       1.933200    
 C    3.120300       2.010100      -1.629800    
 H   -4.584500     -0.1542000      0.9936000    
 H   -3.043300      0.4915000       1.531800    
 H   -4.763200     -0.8776000      -1.325900    
 H   -3.321400      -1.586800      -2.056600    
 H   0.6385000      -1.245700       1.847700    
 H   0.4799000       1.783800      -1.166900    
 H   -4.651200       1.587000     -0.8414000    
 H   -3.093500       2.216200     -0.2878000    
 H   -3.155900      -3.254400     -0.2059000    
 H   -4.607900      -2.577300      0.5420000    
 H   -4.714800      -3.360700      -1.044400    
 H    3.836700      -2.315500       1.330700    
 H    2.640700      -2.114300       2.610900    
 H    4.026200      -1.029000       2.558000    
 H    2.391200       2.653500      -2.135000    
 H    3.832500       2.670200      -1.123300    
 H    3.640600       1.438800      -2.405600    


%chk=000044976-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044976

0 1
Cl -4.130068 0.340864 3.514262
O -0.937429 -0.185781 0.219845
O -1.511268 -0.114264 -2.096441
O 5.422519 0.593253 -0.586684
N -3.116167 -0.461433 -0.423424
N 4.665260 0.475139 0.454634
C -3.438885 -0.674579 1.004696
C -4.213215 -0.544207 -1.424124
C 0.463079 -0.015094 0.111901
C 2.499751 0.191360 1.448352
C 2.591888 0.266689 -1.057617
C -1.838551 -0.247209 -0.892552
C 3.250380 0.312172 0.223390
C 1.107740 0.027641 1.371483
C 1.189088 0.102309 -1.096741
C -3.623708 0.671093 1.725996
C -4.460745 -1.985731 -1.912531
C 3.183347 0.237129 2.801408
C 3.331274 0.387257 -2.373289
H -4.372532 -1.260738 1.063548
H -2.640338 -1.250961 1.496177
H -5.124232 -0.128297 -0.955452
H -3.941911 0.101016 -2.276207
H 0.503406 -0.069612 2.278085
H 0.666234 0.069511 -2.052954
H -4.431904 1.277148 1.289907
H -2.685859 1.241308 1.776506
H -3.564574 -2.378231 -2.422212
H -4.713582 -2.660836 -1.074876
H -5.300935 -2.003249 -2.629995
H 2.444924 0.123336 3.613171
H 3.724640 1.188124 2.943788
H 3.940373 -0.560233 2.893811
H 2.623714 0.323041 -3.217538
H 3.890278 1.337820 -2.436961
H 4.098708 -0.400154 -2.479264


