%chk=000066877.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066877

0 1
 O   -1.044600       1.381100      5.0000002E-04
 O   -3.839000       1.149100     -3.9999999E-04
 N   2.1800000E-02 -0.7120000     -3.0000001E-04
 N   -2.275500     -0.5885000     -7.9999998E-04
 C    1.394400     -0.3700000      1.9999999E-04
 C    2.344400      -1.378500     -1.9999999E-04
 C    1.760700      0.9661000      3.0000001E-04
 C    3.698000      -1.041500     -9.9999997E-05
 C    3.114300       1.302900      1.9999999E-04
 C   -1.077200      0.1531000     -9.9999997E-05
 C    4.082900      0.2991000       0.000000    
 C   -3.559800     -4.6500001E-02 -8.9999998E-04
 C   -4.620400      -1.114500      1.5000000E-03
 H  -0.1809000      -1.708400     -7.9999998E-04
 H    2.055400      -2.425800     -5.0000002E-04
 H    1.073200       1.798700      3.9999999E-04
 H    4.452300      -1.822900     -3.0000001E-04
 H    3.415700       2.346500      3.0000001E-04
 H    5.136800      0.5614000      9.9999997E-05
 H   -2.189200      -1.601300     -5.0000002E-04
 H   -4.509000      -1.751100     -0.8807000    
 H   -4.530900      -1.723400      0.9056000    
 H   -5.610800     -0.6514000     -1.8500000E-02


%chk=000066877-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066877

0 1
O -1.051205 1.434623 -0.000162
O -3.930528 1.152953 -0.002567
N 0.019077 -0.668949 -0.001251
N -2.316302 -0.576251 -0.001454
C 1.395602 -0.294169 -0.000614
C 2.348139 -1.350219 -0.000872
C 1.841035 1.054894 0.000414
C 3.728287 -1.065090 -0.000230
C 3.227918 1.321379 0.001115
C -1.098843 0.183379 -0.000929
C 4.179255 0.275648 0.000804
C -3.642886 -0.064791 -0.001476
C -4.693132 -1.181591 0.002264
H -0.142481 -1.678805 -0.002136
H 2.008779 -2.395400 -0.001606
H 1.109300 1.864332 0.000659
H 4.448600 -1.890898 -0.000485
H 3.563335 2.364733 0.001895
H 5.251396 0.498995 0.001304
H -2.244707 -1.597524 -0.001458
H -4.587507 -1.838528 -0.881690
H -4.609920 -1.807140 0.911087
H -5.690613 -0.719382 -0.017614


