%chk=000002599.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002599

0 1
 O  -0.8636000       2.436300      2.0999999E-03
 N  -1.2900000E-02  -2.994100      1.6000000E-03
 N    3.097500       1.115800     -5.0000002E-04
 N   -2.984000      0.7873000     -1.0000000E-03
 C   0.9194000     -0.7095000      9.9999997E-05
 C   0.7212000      0.6782000      1.9999999E-04
 C  -0.2422000      -1.642100      3.9999999E-04
 C  -0.6379000       1.236900      6.0000003E-04
 C   -1.794200      0.2867000     -8.9999998E-04
 C   -1.497100      -1.158200     -3.9999999E-04
 C    2.249600      -1.153300     -6.0000003E-04
 C    1.817100       1.536900     -9.9999997E-05
 C    3.280300     -0.2196000     -8.9999998E-04
 C   -4.053000     -0.2011000     -6.9999998E-04
 H   -2.311400      -1.874200     -3.9999999E-04
 H    2.519000      -2.203500     -1.0000000E-03
 H    1.701200       2.616100      9.9999997E-05
 H    4.316500     -0.5428000     -1.4000000E-03
 H   0.9211000      -3.377500      3.5999999E-03
 H  -0.8002000      -3.631800      2.0000001E-03
 H   -4.053300     -0.8186000     -0.9058000    
 H   -5.009000      0.3347000     -6.9999998E-04
 H   -4.053200     -0.8181000      0.9047000    


%chk=000002599-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002599

0 1
O -0.839479 2.489458 0.001721
N 0.067394 -3.037597 0.001252
N 3.137490 1.135981 -0.000715
N -3.032482 0.768812 -0.000452
C 0.963326 -0.745051 0.000137
C 0.724947 0.661682 0.000130
C -0.189084 -1.673979 0.000712
C -0.662659 1.238772 0.000365
C -1.817867 0.239635 0.000212
C -1.487010 -1.181447 0.000548
C 2.316313 -1.175076 -0.000384
C 1.835082 1.543767 -0.000281
C 3.351251 -0.215318 -0.000770
C -4.202985 -0.127268 -0.000909
H -2.316693 -1.899490 0.000802
H 2.598018 -2.233309 -0.000645
H 1.652990 2.622928 -0.000310
H 4.400841 -0.530399 -0.001142
H 1.011176 -3.410336 0.002194
H -0.703869 -3.700302 0.001622
H -4.228400 -0.786974 -0.895684
H -5.117962 0.486497 -0.001601
H -4.229440 -0.786484 0.894198


