%chk=000050572.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050572

0 1
 O    2.481100      -2.020000     -0.5086000    
 N   0.2026000      0.2360000     -0.3818000    
 N    2.452200      6.5399997E-02  -2.306500    
 N    1.419900       2.220900      0.1860000    
 N    3.723400     -0.7049000      0.9472000    
 N   0.3039000       2.786700      0.6912000    
 N    4.107600      -1.781600       1.719900    
 C    2.563100      0.3736000     -0.8776000    
 C    1.297700      0.9882000     -0.3154000    
 C  -0.8887000      0.8266000      0.1283000    
 C   -2.105300      5.5599999E-02  8.0899999E-02
 C    2.906600     -0.9225000     -0.1506000    
 C   -3.341700      0.6990000     -2.6300000E-02
 C   -2.056600      -1.340000      0.1413000    
 C  -0.8463000       2.089300      0.6612000    
 C   -4.519400     -4.6999998E-02 -7.2400004E-02
 C   -3.234400      -2.086000      9.4999999E-02
 C   -4.465700      -1.439300     -1.1800000E-02
 H    3.393200       1.080800     -0.7553000    
 H   -3.427100       1.780100     -9.9299997E-02
 H   -1.113900      -1.874500      0.2346000    
 H    3.344100     -0.2924000      -2.647500    
 H    2.279900      0.9256000      -2.826300    
 H   -1.693700       2.597700       1.102800    
 H   -5.478200      0.4555000     -0.1608000    
 H   -3.193300      -3.170200      0.1442000    
 H   -5.382600      -2.020200     -4.8599999E-02
 H    4.045700      0.2186000       1.218800    
 H    3.794100      -1.590000       2.670500    
 H    5.126200      -1.773500       1.752600    


%chk=000050572-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000050572

0 1
O 4.165632 -1.802968 -0.055982
N 0.119802 -0.005764 -0.453362
N 2.162708 -1.146610 -1.835877
N 1.624062 1.555608 0.656365
N 4.033743 0.217249 1.104205
N 0.567415 2.184456 1.267302
N 5.034186 -0.105565 2.066392
C 2.558396 -0.112212 -0.895922
C 1.356004 0.503749 -0.196145
C -0.948575 0.598415 0.165992
C -2.301637 0.053840 -0.081646
C 3.650781 -0.657343 0.115193
C -3.411624 0.416672 0.732273
C -2.503949 -0.854978 -1.157547
C -0.692988 1.723433 1.006189
C -4.691091 -0.113679 0.471413
C -3.784513 -1.379976 -1.418197
C -4.883402 -1.011121 -0.605585
H 3.070370 0.733043 -1.410688
H -3.281094 1.092303 1.584424
H -1.645830 -1.128677 -1.778160
H 2.835513 -1.920809 -1.863055
H 1.184661 -1.431891 -1.726783
H -1.489166 2.292880 1.490328
H -5.536146 0.166308 1.109187
H -3.928850 -2.073389 -2.253396
H -5.879204 -1.420454 -0.807551
H 3.487794 1.081200 1.251653
H 4.852521 -1.035620 2.470831
H 5.968881 -0.080601 1.633851


