%chk=000127032.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127032

0 1
 O    3.681800      -1.102700     -8.0200002E-02
 N   0.2681000       1.103600      0.3802000    
 N    2.645500      0.9410000      3.0500000E-02
 N   -4.820800      0.3286000     -0.1280000    
 C   0.1207000     -0.1977000     -0.2786000    
 C   -1.207400     -0.8257000      0.1372000    
 C    1.292900      -1.102300      0.1017000    
 C   -2.382900      8.7200001E-02 -0.2036000    
 C    1.463700       1.766900     -0.1205000    
 C    2.648400     -0.4362000     -2.3000000E-02
 C   -3.710000     -0.5627000      0.1844000    
 H   0.1108000     -5.2600000E-02  -1.367500    
 H   -1.329600      -1.788500     -0.3747000    
 H   -1.211000      -1.037600       1.214600    
 H    1.291600      -1.993600     -0.5367000    
 H    1.202700      -1.436500       1.143200    
 H   0.3559000      0.9678000       1.387200    
 H   -2.293200       1.044800      0.3233000    
 H   -2.378200      0.3070000      -1.278900    
 H    1.636900       2.697100      0.4293000    
 H    1.361700       2.019700      -1.181500    
 H    3.546000       1.408800     -4.6999999E-03
 H   -3.845600      -1.506400     -0.3546000    
 H   -3.726000     -0.7903000       1.255700    
 H   -4.807300      0.5575000      -1.121400    
 H   -4.699600       1.213100      0.3642000    


%chk=000127032-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127032

0 1
O 3.778988 -1.180359 -0.199584
N 0.367313 1.138955 0.464283
N 2.776620 0.901915 0.020931
N -4.980238 0.257143 -0.163626
C 0.149273 -0.151392 -0.247521
C -1.206240 -0.768917 0.154154
C 1.334155 -1.124629 0.008343
C -2.425206 0.063245 -0.301274
C 1.580212 1.808578 0.018534
C 2.725936 -0.481347 -0.083366
C -3.771718 -0.489837 0.239694
H 0.121059 0.094282 -1.329860
H -1.268700 -1.792401 -0.267930
H -1.228193 -0.890461 1.259817
H 1.322871 -1.974382 -0.697861
H 1.246527 -1.563089 1.023778
H 0.343889 1.007835 1.486477
H -2.292021 1.110791 0.032732
H -2.463961 0.085536 -1.410749
H 1.794793 2.672306 0.672532
H 1.416589 2.186240 -1.011185
H 3.712597 1.313729 -0.050115
H -3.897608 -1.541844 -0.084597
H -3.737134 -0.510653 1.347181
H -5.177250 0.218380 -1.168969
H -5.007453 1.220677 0.185779


