%chk=000097725.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097725

0 1
 O    4.799000      0.4452000     -0.3094000    
 O   -2.675500       1.637700      0.3628000    
 O   -3.577000     -0.1681000     -0.6715000    
 N   -1.527000      -1.791900      4.8000000E-02
 C  -0.1699000      0.2669000     -0.1684000    
 C    1.137000     -0.3726000      0.3148000    
 C   -1.416100     -0.3879000      0.4439000    
 C    2.390100      0.3200000     -0.2350000    
 C    3.708700     -0.2826000      0.2358000    
 C   -2.669200      0.3334000     -2.1000000E-02
 H  -0.2179000      0.2216000      -1.264600    
 H  -0.1507000       1.333600      8.8799998E-02
 H    1.168400     -0.3478000       1.411000    
 H    1.174400      -1.426500      1.6600000E-02
 H   -1.391500     -0.3353000       1.538200    
 H    2.365600      0.3045000      -1.332300    
 H    2.370400       1.382400      4.0199999E-02
 H    3.790400      -1.325600     -8.6700000E-02
 H    3.778800     -0.2454000       1.327700    
 H  -0.7622000      -2.330000      0.4515000    
 H   -1.430900      -1.876400     -0.9634000    
 H    5.613700      2.6500000E-02  1.6899999E-02
 H   -3.482700       2.104200      5.7700001E-02


%chk=000097725-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000097725

0 1
O 4.849525 0.461956 -0.366445
O -2.779427 1.556863 0.594871
O -3.404960 -0.027940 -0.982756
N -1.582144 -1.831305 0.070066
C -0.120563 0.269662 -0.198122
C 1.187778 -0.346109 0.343090
C -1.396837 -0.419344 0.409520
C 2.442838 0.330691 -0.253460
C 3.746484 -0.263436 0.287257
C -2.626707 0.338446 -0.073876
H -0.155111 0.173578 -1.301848
H -0.144477 1.349133 0.048158
H 1.202477 -0.254639 1.449673
H 1.216437 -1.432024 0.111580
H -1.341418 -0.294456 1.509394
H 2.441119 0.229016 -1.355809
H 2.431485 1.414895 -0.030184
H 3.795646 -1.350407 0.054870
H 3.792084 -0.140530 1.391993
H -0.769778 -2.432956 0.205357
H -2.108276 -1.994143 -0.792258
H 5.716053 0.108787 -0.042116
H -3.566327 2.040163 0.222647


