%chk=000019665.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019665

0 1
 O    5.180600       1.217000      4.3000001E-03
 O  -0.8263000      -2.875800      0.7705000    
 N  -0.5973000     -0.9670000     -9.7300000E-02
 N   -1.146800      -2.164700     -0.1894000    
 C   0.7629000     -0.8835000     -0.6163000    
 C    1.592500      8.6800002E-02  0.2227000    
 C   -1.436900      6.0699999E-02 -0.7291000    
 C   -2.522400      0.5280000      0.2390000    
 C    3.020200      0.1962000     -0.3099000    
 C   -3.395000       1.614000     -0.3915000    
 C    3.868700       1.129100      0.5441000    
 C   -4.500100       2.059400      0.5530000    
 H    1.264400      -1.861100     -0.5571000    
 H   0.7834000     -0.6088000      -1.680100    
 H    1.617500     -0.2558000       1.265200    
 H    1.135200       1.083600      0.2248000    
 H   -1.874000     -0.2907000      -1.674800    
 H  -0.8409000      0.9471000     -0.9860000    
 H   -2.061400      0.9175000       1.155800    
 H   -3.159500     -0.3159000      0.5323000    
 H    3.012800      0.5575000      -1.345700    
 H    3.490700     -0.7945000     -0.3409000    
 H   -3.845600       1.238800      -1.317800    
 H   -2.778200       2.480100     -0.6580000    
 H    3.443100       2.137200      0.5608000    
 H    3.941400      0.7701000       1.575800    
 H   -5.110100       2.837000      8.2699999E-02
 H   -5.156800       1.222500      0.8114000    
 H   -4.083300       2.468100       1.479100    
 H    5.559300      0.3214000      7.6000001E-03


%chk=000019665-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000019665

0 1
O 4.887231 1.482216 0.794290
O 0.325102 -3.123928 -0.010875
N -0.671677 -1.227052 -0.689384
N -0.799076 -2.518840 -0.209072
C 0.653416 -0.637456 -0.983172
C 1.399830 -0.123558 0.272486
C -1.939071 -0.521288 -0.951736
C -2.178568 0.706743 -0.043625
C 2.802370 0.412157 -0.093304
C -3.530310 1.387562 -0.358979
C 3.569753 0.924508 1.139706
C -3.794673 2.620641 0.531339
H 1.264068 -1.430616 -1.457489
H 0.502415 0.180487 -1.710798
H 1.489384 -0.956889 0.993827
H 0.807440 0.674767 0.760188
H -2.738716 -1.268353 -0.800153
H -1.963491 -0.206072 -2.014933
H -1.361586 1.444521 -0.175881
H -2.156880 0.385672 1.016131
H 2.722902 1.238709 -0.826952
H 3.387384 -0.397086 -0.579818
H -4.350359 0.652916 -0.227930
H -3.549376 1.690388 -1.425982
H 3.034468 1.768470 1.607651
H 3.666532 0.113790 1.894308
H -4.764100 3.091684 0.287537
H -3.814821 2.341123 1.601226
H -3.005290 3.384203 0.398500
H 5.443801 0.764879 0.398094


