%chk=000014408.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014408

0 1
 Cl   2.961200       4.816600      0.3909000    
 O   -1.178400      -2.070300      -1.120300    
 N  -0.6333000      9.5899999E-02 -0.4941000    
 N   -4.328200      0.3173000      6.8200000E-02
 N    2.377100     -8.7800004E-02 -0.7831000    
 C   -2.954700     -0.1215000      0.3223000    
 C   -2.030600      0.4962000     -0.7323000    
 C   0.2970000       1.156800     -0.1943000    
 C   -2.564200      0.2856000       1.743000    
 C  -0.3665000      -1.275800     -0.6309000    
 C    1.678500       1.078900     -0.4371000    
 C   0.8649000      -1.904000     -0.1161000    
 C    2.136300      -1.384100     -0.3255000    
 C   -5.246200     -0.3049000       1.020700    
 C   -4.719500     -1.9000000E-03  -1.303700    
 C  -0.2127000       2.401300      0.2559000    
 C    2.478800       2.236500     -0.2566000    
 C   0.7175000      -3.178700      0.4683000    
 C    3.250500      -2.166800      4.4900000E-02
 C   0.5951000       3.525000      0.4434000    
 C    1.947200       3.445900      0.1753000    
 C    1.828900      -3.932000      0.8411000    
 C    3.101400      -3.428100      0.6201000    
 H   -2.908600      -1.215900      0.2736000    
 H   -2.254000      6.8599999E-02  -1.719100    
 H   -2.184300       1.568500     -0.8741000    
 H   -2.760900       1.346500       1.933700    
 H   -3.094000     -0.3004000       2.501500    
 H   -1.502800      0.1041000       1.939600    
 H    3.323300      6.9200002E-02  -1.117000    
 H   -5.125500      9.4899997E-02   2.032200    
 H   -5.147500      -1.396300       1.049200    
 H   -6.285600     -7.4900001E-02  0.7557000    
 H   -4.242800      0.6600000      -2.033700    
 H   -5.794100      0.1698000      -1.444600    
 H   -4.518800      -1.046900      -1.567900    
 H   -1.254600       2.542100      0.5268000    
 H    3.551100       2.171100     -0.4436000    
 H  -0.2697000      -3.606400      0.6320000    
 H    4.257900      -1.778200     -9.5799997E-02
 H   0.1466000       4.448400      0.8000000    
 H    1.698200      -4.911600       1.290300    
 H    3.976200      -4.005900      0.9020000    


%chk=000014408-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014408

0 1
Cl 1.788121 4.991554 0.057783
O -0.930859 -2.850319 -0.454044
N -0.691348 -0.547276 -0.484725
N -3.827114 0.914033 0.125327
N 2.249810 -0.104965 -0.886601
C -3.287532 -0.482405 -0.031760
C -2.079948 -0.508708 -1.045371
C -0.030450 0.713605 -0.245494
C -2.920224 -1.135982 1.313596
C -0.178728 -1.836588 -0.259818
C 1.357088 0.931452 -0.500607
C 1.227136 -2.084081 0.209361
C 2.366779 -1.331637 -0.188438
C -4.671768 1.136867 1.322014
C -4.543111 1.366213 -1.091819
C -0.829698 1.825504 0.129254
C 1.894995 2.241292 -0.388418
C 1.429229 -3.289243 0.934740
C 3.669805 -1.825258 0.095115
C -0.300509 3.129430 0.228035
C 1.063989 3.317787 -0.045638
C 2.717982 -3.756506 1.251909
C 3.846246 -3.026915 0.805072
H -4.080908 -1.118003 -0.502298
H -2.176473 -1.424027 -1.651073
H -2.125717 0.367776 -1.712417
H -2.165403 -0.542432 1.860703
H -3.807255 -1.258316 1.957185
H -2.501112 -2.135624 1.119667
H 3.132760 0.237880 -1.273549
H -4.097749 0.959569 2.244752
H -5.586168 0.494286 1.347182
H -5.000877 2.191575 1.328437
H -3.898564 1.286859 -1.983132
H -4.829838 2.427052 -0.982395
H -5.470296 0.772497 -1.288516
H -1.911443 1.676631 0.293607
H 2.962801 2.404833 -0.568847
H 0.542175 -3.872473 1.199128
H 4.543634 -1.247133 -0.230979
H -0.943014 3.970876 0.500119
H 2.844973 -4.685799 1.815694
H 4.858785 -3.387080 1.018160


