%chk=000100261.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100261

0 1
 O   -1.321900       2.782100      7.4600004E-02
 N   -3.807100       1.325700      3.6499999E-02
 N    6.239200      -1.033300     -2.8100001E-02
 N   -2.582800     -0.5285000     -9.8999999E-03
 C   -4.708400      0.2930000     -1.8000000E-03
 C   -3.919600     -0.8538000     -3.0300001E-02
 C    4.972300     -0.4140000     -7.1999999E-03
 C   -2.551700      0.7846000      3.0099999E-02
 C    2.483400      0.8025000      3.3900000E-02
 C    3.849800      -1.135500      0.3994000    
 C    4.841600      0.9201000     -0.3930000    
 C   -6.103400      0.2642000     -1.3600000E-02
 C    2.596800     -0.5230000      0.4200000    
 C    3.588600       1.532600     -0.3724000    
 C   -4.542500      -2.112500     -7.3100001E-02
 C   -1.335200       1.526800      6.2300000E-02
 C    1.159700       1.449600      5.5799998E-02
 C  -8.6000003E-03  0.7909000      5.0600000E-02
 C   -6.706600     -0.9971000     -5.6400001E-02
 C   -5.942000      -2.165700     -8.5699998E-02
 C    6.356400      -2.456900     -0.2740000    
 C    7.441800     -0.2519000      0.1823000    
 H   -4.032900       2.311300      6.4599998E-02
 H    3.920400      -2.170500      0.7221000    
 H    5.692900       1.506700     -0.7267000    
 H   -6.694700       1.172600      9.2000002E-03
 H    1.756700      -1.115600      0.7678000    
 H    3.501800       2.571500     -0.6795000    
 H   -3.957200      -3.026300     -9.6100003E-02
 H    1.172700       2.536700      6.6200003E-02
 H  -6.8700001E-02 -0.2904000      1.2600000E-02
 H   -7.791500      -1.068300     -6.7100003E-02
 H   -6.439600      -3.131500     -0.1188000    
 H    7.372900      -2.722000     -0.5861000    
 H    5.685800      -2.781800      -1.077600    
 H    6.132000      -3.027300      0.6334000    
 H    7.311700      0.4751000      0.9920000    
 H    7.726300      0.2770000     -0.7333000    
 H    8.283900     -0.8924000      0.4678000    


%chk=000100261-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100261

0 1
O -1.416044 2.693454 -0.075048
N -3.807965 1.291679 -0.036492
N 6.424924 -0.964805 -0.002870
N -2.727191 -0.724484 0.006661
C -4.817814 0.331545 -0.011288
C -4.119114 -0.933930 0.015749
C 5.140500 -0.425481 -0.013538
C -2.581094 0.621293 -0.024768
C 2.469529 0.684026 -0.036258
C 3.978676 -1.271809 0.007104
C 4.926548 0.992421 -0.045845
C -6.226927 0.413144 -0.008712
C 2.690553 -0.727919 -0.004043
C 3.628244 1.518164 -0.056640
C -4.852102 -2.145293 0.046133
C -1.322153 1.410700 -0.046199
C 1.149048 1.291426 -0.048125
C -0.072155 0.652228 -0.031817
C -6.932853 -0.806885 0.021780
C -6.257587 -2.066104 0.048787
C 6.616384 -2.422283 0.031183
C 7.597935 -0.078518 -0.021652
H -3.870731 2.310389 -0.059734
H 4.091394 -2.359096 0.032036
H 5.776653 1.679439 -0.062572
H -6.754905 1.371892 -0.029318
H 1.832181 -1.408492 0.012739
H 3.494317 2.606942 -0.081375
H -4.327839 -3.105354 0.066820
H 1.112807 2.391659 -0.072551
H -0.176233 -0.437739 -0.007240
H -8.028420 -0.790725 0.024897
H -6.851584 -2.986169 0.072077
H 7.693585 -2.649851 0.032587
H 6.165444 -2.915786 -0.852760
H 6.171945 -2.873723 0.940684
H 7.619142 0.591338 0.861239
H 7.619110 0.553317 -0.932167
H 8.516091 -0.685909 -0.008966


