%chk=000012193.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012193

1 1
 O   -1.246500     -0.5452000      4.4000000E-03
 O   0.1865000       1.390500     -3.9999999E-04
 N    2.436600     -0.2748000     -1.2000001E-03
 N    3.444300      0.1226000     -3.0000000E-03
 C   -2.298700      0.4136000      4.4999998E-03
 C   -3.627100     -0.3123000     -7.6000001E-03
 C   2.3600001E-02  1.4100000E-02  1.8000000E-03
 C    1.081300     -0.8085000      1.5000000E-03
 H   -2.237900       1.038600      0.9036000    
 H   -2.229600       1.049300     -0.8864000    
 H   -4.460100      0.3962000     -7.8999996E-03
 H   -3.708300     -0.9534000     -0.8917000    
 H   -3.718300     -0.9644000      0.8673000    
 H   0.9527000      -1.885400      3.3000000E-03
 H    1.141300       1.578200     -2.0000001E-03


%chk=000012193-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000012193

1 1
O -1.157055 -0.387844 0.000103
O 0.168446 1.464569 0.003225
N 2.420965 -0.457204 0.000484
N 3.563218 -0.202050 0.000305
C -2.408509 0.528735 0.001153
C -3.605976 -0.398441 -0.006013
C 0.063799 0.113111 0.000922
C 1.133251 -0.826680 -0.000581
H -2.326452 1.148422 0.909771
H -2.322249 1.157254 -0.900962
H -4.521227 0.221564 -0.004798
H -3.628682 -1.030834 -0.907820
H -3.632373 -1.039791 0.889339
H 0.917188 -1.897149 -0.002612
H 1.075456 1.865440 0.003684


