%chk=000042451.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042451

0 1
 Cl   5.608800     -0.3598000       1.052000    
 O   0.2144000     -0.8057000      -1.247300    
 O   -1.103800       3.235300      0.8276000    
 O   -2.108500       2.604700      -1.028100    
 N   -1.243100       2.487800     -0.1499000    
 C  -0.8084000      0.1886000      -1.002400    
 C  -0.3319000       1.402100     -0.2743000    
 C   -1.903500     -0.5193000     -0.2703000    
 C    1.826900      0.5028000      4.5699999E-02
 C    1.451400     -0.6343000     -0.6820000    
 C   0.8835000       1.598600      0.2293000    
 C   -2.868600      -1.227900     -0.9822000    
 C   -1.954500     -0.4673000       1.120600    
 C    3.118500      0.5818000      0.5802000    
 C    2.361300      -1.677700     -0.8723000    
 C    4.023000     -0.4642000      0.3908000    
 C    3.644800      -1.592400     -0.3347000    
 C   -3.890300      -1.888000     -0.2995000    
 C   -2.976000      -1.127400       1.803500    
 C   -3.944000      -1.837700       1.093400    
 H   -1.158600      0.4870000      -1.999300    
 H    1.220900       2.497500      0.7318000    
 H   -2.836600      -1.276000      -2.067400    
 H   -1.208700      5.0000001E-02   1.716100    
 H    3.420600       1.461700       1.145000    
 H    2.075500      -2.561100      -1.437300    
 H    4.340200      -2.413200     -0.4905000    
 H   -4.643500      -2.441800     -0.8523000    
 H   -3.014800      -1.093800       2.888500    
 H   -4.738500      -2.352900       1.625200    


%chk=000042451-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000042451

0 1
Cl 5.318371 -0.782317 1.620677
O 0.245509 -0.486769 -1.602607
O -0.846230 3.876608 0.144472
O -2.353843 2.710468 -1.127390
N -1.231728 2.810370 -0.480253
C -0.914571 0.385652 -1.144979
C -0.370658 1.629013 -0.469323
C -1.866986 -0.439688 -0.289353
C 1.722257 0.514620 0.097721
C 1.381576 -0.548115 -0.799833
C 0.847950 1.670629 0.151525
C -2.905101 -1.160706 -0.930723
C -1.718414 -0.540753 1.116784
C 2.936332 0.438969 0.835330
C 2.245930 -1.651315 -0.968203
C 3.769392 -0.674842 0.669750
C 3.443059 -1.719536 -0.226962
C -3.778308 -1.977317 -0.181906
C -2.589586 -1.360519 1.866983
C -3.620141 -2.080907 1.220309
H -1.404292 0.647862 -2.095747
H 1.160371 2.589031 0.660090
H -3.028932 -1.075921 -2.017001
H -0.932522 0.024664 1.629719
H 3.211002 1.247152 1.520495
H 1.972242 -2.443302 -1.670288
H 4.114265 -2.575436 -0.341541
H -4.581596 -2.525578 -0.685703
H -2.469534 -1.432910 2.953427
H -4.299315 -2.711708 1.804429


