%chk=000017803.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017803

0 1
 O    2.137100     -0.9711000     -9.9999997E-05
 N  -0.1421000      -1.369000      3.0000001E-04
 N   0.7309000      0.8661000      1.9999999E-04
 N   -1.641200      0.5047000       0.000000    
 N   -2.464900      -1.691000     -3.0000001E-04
 N  -0.7585000       2.677300     -9.9999997E-05
 C   0.8561000     -0.4707000      1.9999999E-04
 C   -1.362500     -0.8089000      9.9999997E-05
 C  -0.5460000       1.281600       0.000000    
 C    3.191000     -1.8900000E-02 -1.9999999E-04
 H   -2.303300      -2.688600      3.0000001E-04
 H   -3.402700      -1.314400      9.9999997E-05
 H   3.6600001E-02   3.301100      5.0000002E-04
 H   -1.703200       3.036200      3.0000001E-04
 H    3.161600      0.6015000      0.9019000    
 H    3.161000      0.6022000     -0.9018000    
 H    4.138900     -0.5654000     -6.9999998E-04


%chk=000017803-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000017803

0 1
O 2.128440 -0.984433 -0.000149
N -0.138083 -1.372908 -0.000080
N 0.723233 0.905380 0.000000
N -1.691577 0.523456 0.000189
N -2.454635 -1.691963 0.000085
N -0.797717 2.688045 0.000223
C 0.859873 -0.450822 -0.000129
C -1.398771 -0.820693 0.000053
C -0.588005 1.334453 0.000170
C 3.255655 -0.034833 -0.000117
H -2.265016 -2.690940 0.000035
H -3.402513 -1.325099 0.000225
H 0.003616 3.313256 0.000203
H -1.751326 3.040297 0.000314
H 3.227813 0.607142 0.897148
H 3.227600 0.607470 -0.897138
H 4.150213 -0.675108 -0.000332


