%chk=000104129.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104129

0 1
 O   -3.762200      0.7037000      -1.152600    
 O   -2.552700       1.539100      0.5721000    
 N   -2.393700     -0.7012000     -4.5499999E-02
 N    2.555500       2.546600     -0.6103000    
 C  -2.6200000E-02 -0.9904000      0.4503000    
 C    1.984700      0.3290000      0.2208000    
 C   0.6724000      0.1960000      0.6747000    
 C   -1.429700      -1.133100      0.9346000    
 C   0.5877000      -2.043600     -0.2279000    
 C    2.731500       1.597800      0.4597000    
 C    2.598400     -0.7242000     -0.4573000    
 C    1.899900      -1.910500     -0.6816000    
 C   -2.865500      0.5907000     -0.1370000    
 H   0.1957000       1.017600       1.203800    
 H   -1.651800      -2.179400       1.174200    
 H   -1.575000     -0.5618000       1.859400    
 H   5.3599998E-02  -2.972200     -0.4109000    
 H    2.410500       2.050500       1.405600    
 H    3.799900       1.386300      0.5878000    
 H    3.619600     -0.6327000     -0.8175000    
 H    2.377400      -2.730200      -1.210400    
 H   -2.735700      -1.382900     -0.7160000    
 H    1.568500       2.771200     -0.7278000    
 H    2.870400       2.148700      -1.494000    
 H   -4.109200       1.617700      -1.233100    


%chk=000104129-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000104129

0 1
O -3.810369 1.370806 -0.694567
O -3.441251 0.714940 1.534478
N -2.302963 -0.283654 -0.270271
N 2.572942 2.475947 -1.033783
C -0.003327 -1.099122 0.273159
C 2.031796 0.297919 0.166456
C 0.635087 0.161810 0.360638
C -1.503487 -1.230634 0.522065
C 0.775543 -2.246400 -0.016471
C 2.695283 1.678873 0.211797
C 2.795616 -0.866143 -0.110111
C 2.171810 -2.129806 -0.203702
C -3.189199 0.588167 0.307925
H 0.032323 1.050267 0.593603
H -1.828369 -2.268172 0.310676
H -1.747254 -1.020467 1.580147
H 0.292565 -3.228863 -0.089296
H 2.260527 2.279632 1.031998
H 3.772149 1.565191 0.435878
H 3.881014 -0.779984 -0.248442
H 2.770556 -3.022105 -0.418620
H -2.200242 -0.260656 -1.285440
H 1.613154 2.776119 -1.236493
H 2.998891 2.024474 -1.850692
H -4.448796 1.984563 -0.249832


