%chk=000127439.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127439

0 1
 O    2.226000       1.214800     -7.4699998E-02
 O    2.458300      -1.059500     -1.6600000E-02
 N  -0.3457000       1.157800      2.4100000E-02
 C   -2.475400      3.7700001E-02 -0.3609000    
 C   -1.777300       1.263400      0.2357000    
 C   -1.833900      -1.279500      0.1088000    
 C  -0.3287000      -1.230300      8.1000000E-02
 C   0.3068000     -4.9800001E-02  2.5500000E-02
 C    1.769900     -5.4499999E-02 -2.3000000E-02
 H   -2.409700      8.9599997E-02  -1.456000    
 H   -3.541100      4.7400001E-02 -0.1062000    
 H   -2.155600       2.179200     -0.2297000    
 H   -1.980500       1.325400       1.310800    
 H   -2.183600      -2.094000     -0.5356000    
 H   -2.157900      -1.510300       1.130300    
 H   0.2162000       2.002200      1.9900000E-02
 H   0.2016000      -2.177000      0.1091000    
 H    3.205700       1.253500     -0.1082000    


%chk=000127439-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127439

0 1
O 2.293273 1.273483 -0.085169
O 2.554917 -1.039039 -0.046968
N -0.342518 1.186660 0.017770
C -2.488897 0.032738 -0.393145
C -1.788117 1.251166 0.257634
C -1.879815 -1.297676 0.123713
C -0.366811 -1.251439 0.110163
C 0.304621 -0.049962 0.036462
C 1.786610 -0.048504 -0.032102
H -2.361087 0.094557 -1.489592
H -3.572114 0.072428 -0.177332
H -2.181710 2.192162 -0.168483
H -2.012913 1.258952 1.347798
H -2.237216 -2.140676 -0.499985
H -2.248884 -1.509297 1.149996
H 0.227536 2.029577 -0.007397
H 0.223494 -2.171349 0.127990
H 3.284732 1.232319 -0.137055


