%chk=000005219.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005219

0 1
 O   -3.561800     -0.1343000     -0.2987000    
 O    2.741900       1.033100     -0.2822000    
 N  -0.7708000     -1.7899999E-02  0.2645000    
 N   0.6744000      0.1226000      0.1113000    
 N    1.332000       1.366100     -0.2480000    
 N    3.970700     -0.9479000      0.1054000    
 C   -1.560100       1.195900      2.8200001E-02
 C   -1.374900      -1.178000     -0.3999000    
 C   -3.018600      0.9753000      0.4158000    
 C   -2.838800      -1.327500      1.2000001E-03
 C    1.527700     -0.8061000      0.2716000    
 C    2.878200     -0.2815000      3.0700000E-02
 H   -1.505400       1.475200      -1.032300    
 H   -1.177700       2.034700      0.6221000    
 H  -0.8570000      -2.105900     -0.1335000    
 H   -1.302500      -1.055600      -1.488400    
 H   -3.128500      0.8062000       1.494100    
 H   -3.610600       1.859300      0.1581000    
 H   -3.298000      -2.145400     -0.5633000    
 H   -2.943400      -1.561700       1.067700    
 H    1.336300      -1.845800      0.5540000    
 H    4.757200     -0.3266000     -0.1126000    


%chk=000005219-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005219

0 1
O -3.604215 0.023941 -0.212871
O 2.481945 0.265970 -1.185626
N -0.777941 -0.223797 0.202135
N 0.621283 -0.127451 -0.080215
N 1.031598 0.317568 -1.314515
N 4.079933 -0.377133 0.623977
C -1.427649 1.129737 0.240380
C -1.478687 -1.137123 -0.761472
C -2.881343 0.921759 0.701225
C -2.929883 -1.282776 -0.269984
C 1.589291 -0.449890 0.818150
C 2.868051 -0.226190 0.199517
H -1.405622 1.614168 -0.757636
H -0.882645 1.761353 0.963277
H -0.969086 -2.116190 -0.751456
H -1.461945 -0.728045 -1.792195
H -2.892163 0.503854 1.730133
H -3.432381 1.875480 0.682121
H -3.517007 -1.891509 -0.975947
H -2.940571 -1.758822 0.733319
H 1.361246 -0.817868 1.809965
H 4.838090 -0.142833 -0.036481


