%chk=000084211.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084211

0 1
 O    3.597000      -1.739900      9.9999997E-05
 O    4.108200      0.8584000     -1.5000000E-03
 O   -4.383700      0.5760000      1.9999999E-04
 O   -3.840100      -1.631000     -5.0000002E-04
 N    1.319300      -1.354900      3.9999999E-04
 N    1.854300       1.365000      3.0000001E-04
 C   0.2577000     -0.4428000      3.9999999E-04
 C   0.5264000      0.9228000      3.9999999E-04
 C   -1.060600     -0.9002000      9.9999997E-05
 C  -0.5205000       1.845600      1.9999999E-04
 C   -2.109200      2.0600000E-02   0.000000    
 C   -1.839600       1.390500     -9.9999997E-05
 C    2.642700     -0.9720000      3.0000001E-04
 C    2.934100      0.5094000      3.0000001E-04
 C   -3.485900     -0.4474000     -5.0000002E-04
 H   -1.261700      -1.968900     -9.9999997E-05
 H  -0.3223000       2.914000      1.9999999E-04
 H    1.099200      -2.346700      3.0000001E-04
 H    2.026000       2.366400     -9.9999997E-05
 H   -2.627800       2.138300     -3.0000001E-04
 H   -5.309000      0.2498000      3.0000001E-04


%chk=000084211-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000084211

0 1
O 3.602579 -1.879054 -0.000256
O 4.177224 0.956329 -0.000587
O -4.486439 0.561313 -0.000857
O -3.854004 -1.675382 -0.000385
N 1.338588 -1.341727 0.000083
N 1.885830 1.348301 -0.000240
C 0.253209 -0.444831 0.000249
C 0.540055 0.952959 0.000083
C -1.083339 -0.885206 0.000594
C -0.519466 1.892066 0.000270
C -2.138026 0.058452 0.000831
C -1.852468 1.450353 0.000601
C 2.701319 -1.004729 -0.000280
C 3.008417 0.499358 -0.000474
C -3.527557 -0.463243 0.001330
H -1.332219 -1.952323 0.000764
H -0.292787 2.963980 0.000152
H 1.145948 -2.349313 0.000243
H 2.109213 2.349740 -0.000319
H -2.679087 2.164320 0.000770
H -5.392491 0.151636 -0.002171


