%chk=000011972.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011972

0 1
 O  -0.9705000       2.372500       0.000000    
 O    2.466500      -1.401200     -2.0999999E-03
 N    1.191500      0.5816000      3.9999999E-04
 C  -0.1288000      0.1255000      6.9999998E-04
 C   -1.192800       1.027400     -3.9999999E-04
 C  -0.3779000      -1.247000      1.2000001E-03
 C   -2.505900      0.5569000     -1.0000000E-03
 C   -1.691000      -1.717500      6.0000003E-04
 C   -2.755100     -0.8156000     -3.0000001E-04
 C    2.367500     -0.1783000      6.0000003E-04
 C    3.596600      0.6958000      1.9999999E-04
 H   0.3880000      -2.009200      2.3000001E-03
 H    1.298000       1.594000      1.9999999E-04
 H   -3.344700       1.247900     -1.7000000E-03
 H   -1.886600      -2.786000      1.1000000E-03
 H   -3.777400      -1.182100     -6.9999998E-04
 H    3.615300       1.306300     -0.9068000    
 H    4.494700      7.2600000E-02  2.8200001E-02
 H    3.589500       1.346600      0.8791000    
 H   -1.825700       2.835800     -6.9999998E-04


%chk=000011972-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000011972

0 1
O -0.789688 2.315706 0.001937
O 2.496889 -1.391790 0.003571
N 1.184488 0.554401 0.002006
C -0.126276 0.013574 0.000873
C -1.194183 0.958345 0.000862
C -0.439539 -1.368516 -0.000092
C -2.538184 0.545692 -0.000126
C -1.791270 -1.782792 -0.001105
C -2.839900 -0.837041 -0.001109
C 2.401048 -0.128826 0.002345
C 3.620733 0.794596 -0.000835
H 0.381174 -2.087799 0.000177
H 1.210899 1.578981 0.002223
H -3.343555 1.291591 -0.000078
H -2.020482 -2.853514 -0.001810
H -3.884543 -1.164653 -0.001817
H 3.646617 1.416485 -0.914826
H 4.529218 0.176454 0.033111
H 3.614710 1.471009 0.873809
H -1.566956 2.924097 0.001784


