%chk=000023451.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023451

0 1
 O    5.534300       1.056700     -0.3118000    
 O    5.469400      -1.136100     -0.2305000    
 N   -1.238700      0.1524000     -0.4869000    
 N  -0.6469000      0.1758000      0.6171000    
 N    4.900300     -1.8700000E-02 -0.1845000    
 C   -3.365200     -0.9717000     -0.1391000    
 C   -2.623900      0.2008000     -0.2863000    
 C   -4.744100     -0.9045000      6.0899999E-02
 C   0.7432000      0.1271000      0.4163000    
 C   -3.261600       1.440400     -0.2336000    
 C   -2.704600      -2.310400     -0.1905000    
 C    3.495800      3.0400001E-02  1.8200001E-02
 C   -5.381600      0.3351000      0.1136000    
 C    1.462000       1.309700      0.2729000    
 C    1.390300      -1.103600      0.3622000    
 C   -4.640400       1.507400     -3.3700000E-02
 C    2.841700       1.261300      7.3200002E-02
 C    2.770000      -1.152100      0.1625000    
 H   -5.336200      -1.808200      0.1790000    
 H   -2.693600       2.360100     -0.3479000    
 H   -2.088200      -2.404400      -1.090900    
 H   -2.076600      -2.459200      0.6938000    
 H   -3.437500      -3.124100     -0.2187000    
 H   -6.455200      0.3876000      0.2697000    
 H   0.9600000       2.272600      0.3153000    
 H   0.8320000      -2.029200      0.4743000    
 H   -5.136900       2.472500      7.3000002E-03
 H    3.374500       2.202600     -3.5000000E-02
 H    3.245800      -2.128800      0.1252000    


%chk=000023451-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000023451

0 1
O 5.858452 0.962971 -0.091463
O 5.564291 -1.297336 -0.210119
N -1.313913 -0.298183 0.022190
N -0.534428 0.755470 0.057348
N 5.109750 -0.089787 -0.131212
C -3.574455 -1.164025 0.037836
C -2.712350 -0.018658 0.070402
C -4.971922 -0.938831 0.083478
C 0.864140 0.448925 0.006169
C -3.251525 1.299937 0.145822
C -3.020227 -2.572720 -0.042859
C 3.641009 0.098477 -0.083445
C -5.505622 0.367148 0.158103
C 1.727769 1.577131 0.048285
C 1.411905 -0.865277 -0.081757
C -4.641115 1.491529 0.189243
C 3.122733 1.409974 0.003897
C 2.801985 -1.042535 -0.126733
H -5.648896 -1.800252 0.060096
H -2.554788 2.143304 0.168225
H -2.414444 -2.712728 -0.955547
H -2.354160 -2.790734 0.810367
H -3.837648 -3.313544 -0.048122
H -6.591500 0.510055 0.191731
H 1.276414 2.571578 0.115698
H 0.727784 -1.717736 -0.112923
H -5.057686 2.502799 0.246803
H 3.809934 2.258987 0.034845
H 3.256614 -2.034439 -0.194260


