%chk=000137976.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137976

0 1
 O   -2.341000     -0.4764000      9.9999997E-05
 O    2.291600     -0.5964000     -3.0000001E-04
 N  -2.3399999E-02 -0.5607000      9.9999997E-05
 N    1.262200       1.477500      9.9999997E-05
 C   -1.144400      0.1901000     -1.9999999E-04
 C   -1.142800       1.570200     -9.9999997E-05
 C    1.128000      0.1375000      3.0000001E-04
 C   0.1018000       2.165800     -9.9999997E-05
 C   -2.282600      -1.897900       0.000000    
 C    2.150700      -2.009700       0.000000    
 H   -2.054600       2.153100     -9.9999997E-05
 H   0.2035000       3.245800     -9.9999997E-05
 H   -3.308800      -2.277200      9.9999997E-05
 H   -1.784900      -2.270500      0.9016000    
 H   -1.785000      -2.270400     -0.9018000    
 H    1.633100      -2.354400     -0.9016000    
 H    1.633500      -2.354200      0.9020000    
 H    3.153000      -2.448300     -3.0000001E-04


%chk=000137976-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000137976

0 1
O -2.388227 -0.461023 0.000205
O 2.332687 -0.568626 -0.000322
N -0.025454 -0.566161 -0.000323
N 1.294779 1.489125 -0.000351
C -1.164568 0.173759 0.000038
C -1.153424 1.593065 0.000117
C 1.148172 0.135295 -0.000715
C 0.121208 2.194321 -0.000003
C -2.385199 -1.937496 0.000003
C 2.244423 -2.039755 0.000109
H -2.079208 2.169229 0.000325
H 0.224853 3.284320 0.000110
H -3.449745 -2.212887 0.000060
H -1.874447 -2.326017 0.897917
H -1.874602 -2.325783 -0.898098
H 1.713700 -2.401665 -0.897851
H 1.713062 -2.401145 0.897898
H 3.291890 -2.374656 0.000579


