%chk=000113024.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113024

1 1
 O    2.713400       2.008200     -0.4686000    
 O    1.754500      -2.567600     -0.3666000    
 N    2.398300      4.1200001E-02  0.6243000    
 C    1.164300      0.5097000      0.2290000    
 C    2.688000      -1.161700       1.341800    
 C    1.359600       1.718500     -0.4425000    
 C    3.255400      0.9417000      0.1974000    
 C  -0.1130000     -1.9200001E-02  0.4001000    
 C   -1.176400      0.7229000     -0.1342000    
 C   0.3224000       2.469600     -0.9791000    
 C    2.927500      -2.330400      0.3998000    
 C  -0.9624000       1.936900     -0.8068000    
 C    4.715400      0.9260000      0.3566000    
 C   -2.528600      0.2234000      1.1500000E-02
 C   -3.285900      0.5818000       1.125700    
 C   -3.069800     -0.6140000     -0.9626000    
 C   -4.587800      0.1013000       1.266200    
 C   -4.371900      -1.094300     -0.8220000    
 C   -5.130800     -0.7366000      0.2924000    
 C    1.927900      -3.657500      -1.262300    
 H    1.846600      -1.384000       2.008600    
 H    3.564300      -1.009600       1.981700    
 H  -0.2800000     -0.9562000      0.9208000    
 H   0.4915000       3.405300      -1.497000    
 H    3.170900      -3.225100      0.9839000    
 H    3.763700      -2.110400     -0.2735000    
 H   -1.806700       2.493200      -1.212300    
 H    4.987400      0.9885000       1.414400    
 H    5.142100      8.0000004E-03 -5.7700001E-02
 H    5.180500       1.772000     -0.1592000    
 H   -2.877700       1.234200       1.893900    
 H   -2.491600     -0.9026000      -1.837200    
 H   -5.178900      0.3797000       2.133800    
 H   -4.794900      -1.746900      -1.580100    
 H   -6.144500      -1.110700      0.4018000    
 H    2.734100      -3.446300      -1.971500    
 H   0.9983000      -3.793900      -1.821400    
 H    2.141800      -4.577700     -0.7102000    


%chk=000113024-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000113024

1 1
O 2.823317 2.085791 -0.621227
O 1.548157 -2.624912 0.212768
N 2.549041 0.187754 0.535062
C 1.240789 0.579387 0.103775
C 2.875658 -0.994838 1.376610
C 1.425477 1.780294 -0.618344
C 3.450790 1.096035 0.089286
C -0.031844 0.013343 0.270548
C -1.131788 0.711187 -0.301432
C 0.377274 2.493897 -1.203186
C 2.916490 -2.316549 0.596938
C -0.903901 1.934890 -1.019727
C 4.920199 1.148650 0.291249
C -2.513020 0.173141 -0.163485
C -2.899797 -0.542027 1.004079
C -3.472755 0.356895 -1.197554
C -4.205876 -1.056584 1.134423
C -4.778085 -0.160762 -1.067813
C -5.150511 -0.868755 0.098405
C 1.425104 -3.901864 -0.511104
H 2.106026 -1.064902 2.163861
H 3.848945 -0.811654 1.860582
H -0.157474 -0.958967 0.750323
H 0.534269 3.425896 -1.750053
H 3.329657 -3.097821 1.272302
H 3.580439 -2.241105 -0.292814
H -1.766446 2.471559 -1.424950
H 5.174725 1.377738 1.343252
H 5.404109 0.193350 0.024279
H 5.343851 1.944419 -0.339748
H -2.191550 -0.663193 1.831963
H -3.193031 0.872582 -2.123333
H -4.491722 -1.591326 2.046092
H -5.501317 -0.019196 -1.877461
H -6.165378 -1.266766 0.199955
H 2.006433 -3.882938 -1.454091
H 0.355724 -4.017674 -0.739088
H 1.765023 -4.747573 0.118558


