%chk=000012911.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012911

0 1
 Cl  -1.182400      -3.159700      0.3560000    
 O  -8.1600003E-02   1.940000     -0.8592000    
 N    3.944400     -3.3599999E-02  0.4399000    
 N  -0.2673000     -0.3448000     -0.3404000    
 C    2.504400      0.1711000      0.6067000    
 C    1.907200      0.6217000     -0.7322000    
 C    4.199700      -1.060900     -0.5683000    
 C    4.597900       1.220800      7.0200004E-02
 C    2.279800       1.204300       1.710100    
 C   0.4027000      0.8304000     -0.6557000    
 C    3.526800      -2.372000     -0.1987000    
 C    6.101800       1.041900     -4.9400002E-02
 C   -1.662000     -0.5272000     -0.1861000    
 C   -3.865000      0.4286000     -0.2199000    
 C   -2.485300      0.5748000     -0.3631000    
 C   -2.185300      -1.771000      0.1308000    
 C   -4.763100       1.604300     -0.4075000    
 C   -4.405000     -0.8173000      9.8899998E-02
 C   -3.565000      -1.917100      0.2742000    
 C   -5.002400       2.366000      0.8936000    
 H    2.029500     -0.7440000      0.9739000    
 H    2.304600       1.579400      -1.082700    
 H    2.046400     -0.1060000      -1.537900    
 H    5.270400      -1.296900     -0.5712000    
 H    3.963000     -0.7690000      -1.597000    
 H    4.263800       1.639600     -0.8834000    
 H    4.460400       1.986700      0.8393000    
 H    2.445600       2.235600       1.381100    
 H    2.906200       1.004900       2.587200    
 H    1.239600       1.157900       2.054900    
 H    3.701700      -2.639700      0.8493000    
 H    2.449500      -2.362200     -0.3890000    
 H    3.942200      -3.180900     -0.8109000    
 H    6.519000      0.5248000      0.8216000    
 H    6.389800      0.5003000     -0.9559000    
 H    6.585600       2.023800     -0.1064000    
 H   0.2857000      -1.189900     -0.2204000    
 H   -2.142800       1.568400     -0.6070000    
 H   -5.726400       1.276600     -0.8183000    
 H   -4.340700       2.285700      -1.156400    
 H   -5.478200     -0.9439000      0.2150000    
 H   -4.001800      -2.881100      0.5228000    
 H   -5.468300       1.723700       1.648600    
 H   -5.665600       3.218400      0.7157000    
 H   -4.062700       2.746200       1.308200    


%chk=000012911-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000012911

0 1
Cl -0.939542 -3.017726 -0.775026
O -0.204582 2.286274 -0.571434
N 3.944059 0.024747 0.274210
N -0.317185 -0.059182 -0.736933
C 2.571740 0.560708 0.475212
C 1.875130 1.006373 -0.876869
C 3.985696 -1.355415 -0.273903
C 4.892404 0.945513 -0.410218
C 2.538381 1.699942 1.513819
C 0.367343 1.165391 -0.728958
C 3.468776 -2.430602 0.702849
C 6.349991 0.747983 0.051791
C -1.700026 -0.307478 -0.574947
C -4.045264 0.413520 -0.271267
C -2.671305 0.718569 -0.418316
C -2.162683 -1.652313 -0.577121
C -5.052137 1.535241 -0.058909
C -4.462552 -0.941333 -0.284491
C -3.517527 -1.980830 -0.437042
C -5.185223 1.928299 1.437496
H 1.979175 -0.275652 0.892887
H 2.282301 1.979699 -1.197254
H 2.104114 0.256198 -1.660451
H 5.041696 -1.581018 -0.507896
H 3.432258 -1.437631 -1.246561
H 4.836621 0.839004 -1.522304
H 4.591974 1.983183 -0.180520
H 3.100561 2.588421 1.172756
H 2.982621 1.352418 2.462025
H 1.499590 2.024860 1.699134
H 4.007154 -2.357548 1.663719
H 2.386747 -2.337454 0.908493
H 3.635056 -3.438592 0.279747
H 6.429757 0.914275 1.139975
H 6.717078 -0.272071 -0.163061
H 7.019285 1.459749 -0.467060
H 0.253841 -0.899042 -0.878379
H -2.320969 1.753650 -0.417637
H -6.043936 1.227001 -0.441078
H -4.747001 2.427635 -0.637065
H -5.524394 -1.190193 -0.178561
H -3.829453 -3.029024 -0.450281
H -5.516986 1.066795 2.045100
H -5.920039 2.744217 1.564772
H -4.215748 2.272137 1.840555


