%chk=000097188.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097188

0 1
 O   -2.287600     -0.1914000      0.8958000    
 O   -3.392800       2.528300     -5.9500001E-02
 O   -4.340100      -2.076800      0.6776000    
 N  -6.9700003E-02 -0.2936000      6.0300000E-02
 N    1.166500      -2.128600     -0.2405000    
 N    1.695300       1.365700      0.2485000    
 N    3.902100      0.3454000      3.6300000E-02
 N    4.204000      -2.002800     -0.3129000    
 N    3.647800       2.649200      0.3748000    
 C   -1.254000      0.5427000      0.2168000    
 C   -3.295300       1.259800     -0.7036000    
 C   -1.852900       1.031900      -1.094000    
 C   -3.561000      0.1511000      0.3092000    
 C   -4.137500      -1.103700     -0.3320000    
 C    1.235300      0.1167000      8.1400000E-02
 C  -5.6299999E-02  -1.651500     -0.1353000    
 C    1.983600      -1.034300     -0.1070000    
 C    3.367100     -0.8887000     -0.1268000    
 C    3.045500       1.380600      0.2112000    
 H  -0.9737000       1.380500      0.8664000    
 H   -3.983200       1.264400      -1.553000    
 H   -1.791500      0.2551000      -1.865400    
 H   -1.342800       1.927800      -1.461200    
 H   -4.209000      0.4838000       1.128000    
 H   -3.448400      -1.527800      -1.069500    
 H   -5.097200     -0.8917000     -0.8135000    
 H  -0.9619000      -2.239400     -0.1978000    
 H   -2.901800       2.495900      0.7784000    
 H   -4.708700      -2.866000      0.2454000    
 H    3.807400      -2.924800     -0.4344000    
 H    5.206200      -1.871000     -0.3234000    
 H    3.063100       3.462600      0.5091000    
 H    4.655200       2.726600      0.3563000    


%chk=000097188-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097188

0 1
O -2.646476 0.039539 1.223385
O -4.060655 2.465668 0.082325
O -3.436155 -2.349709 -0.266556
N -0.326079 -0.224349 0.651140
N 0.812819 -2.218229 0.638560
N 1.503761 1.299660 -0.063912
N 3.614117 0.067026 -0.460253
N 3.801243 -2.267444 -0.172284
N 3.469158 2.379975 -0.752895
C -1.407283 0.759618 0.914489
C -3.228592 1.455041 -0.583572
C -1.712439 1.667689 -0.314516
C -3.497946 0.046655 -0.006201
C -3.171221 -1.093725 -0.977022
C 0.981078 0.081241 0.253466
C -0.365730 -1.618911 0.885664
C 1.663993 -1.164775 0.247284
C 3.038942 -1.128225 -0.131616
C 2.832983 1.204572 -0.410741
H -1.139558 1.331493 1.819639
H -3.492190 1.551980 -1.648416
H -1.097606 1.365392 -1.177346
H -1.501256 2.727720 -0.109112
H -4.532495 -0.062922 0.357241
H -2.116134 -1.037488 -1.315941
H -3.836368 -0.990252 -1.862240
H -1.284623 -2.104866 1.204113
H -3.943696 2.366633 1.063207
H -3.172295 -3.114606 -0.837028
H 3.382008 -3.158590 0.083542
H 4.780987 -2.202790 -0.437829
H 2.949495 3.251906 -0.724225
H 4.451912 2.351072 -1.006650


