%chk=000112849.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112849

0 1
 O    2.549000       1.184300      2.6699999E-02
 O    4.391700     -0.1074000      2.1600001E-02
 N    1.014800      -1.162400     -1.6600000E-02
 N    2.359000      -1.144700     -2.0400001E-02
 C   0.3909000     -3.0200001E-02 -1.4100000E-02
 C   -1.105700     -1.3300000E-02 -4.0000002E-03
 C    1.134000       1.282100     -2.8100001E-02
 C   -1.790700       1.201800     -7.7000000E-03
 C   -1.815600      -1.214000      7.4999998E-03
 C   -3.185400       1.216300       0.000000    
 C   -3.210400      -1.199400      1.5100000E-02
 C   -3.895300      1.5600000E-02  1.1400000E-02
 C    3.163800     -2.8800000E-02  8.8000000E-03
 H   0.8807000       1.828400     -0.9425000    
 H   0.8256000       1.878900      0.8361000    
 H   -1.279700       2.159100     -1.9600000E-02
 H   -1.310800      -2.176100      1.0500000E-02
 H   -3.719300       2.162200     -3.7000000E-03
 H   -3.763500      -2.134000      2.3800001E-02
 H   -4.981300      2.7000001E-02  1.7100001E-02
 H    2.784200      -2.066600     -3.2099999E-02


%chk=000112849-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000112849

0 1
O 2.495509 1.104616 0.569856
O 4.424648 -0.179312 0.431251
N 0.990255 -1.149447 -0.247079
N 2.391205 -1.080471 -0.295357
C 0.362595 0.009398 -0.099658
C -1.113596 0.011241 -0.023003
C 1.169704 1.297418 -0.087190
C -1.853064 1.227173 -0.023720
C -1.827286 -1.221681 0.037199
C -3.263698 1.210857 0.034740
C -3.232600 -1.233150 0.095174
C -3.959873 -0.016644 0.095981
C 3.201596 -0.059329 0.227164
H 1.343797 1.655455 -1.122876
H 0.697421 2.097842 0.498557
H -1.341579 2.194499 -0.078121
H -1.257268 -2.155382 0.039321
H -3.817234 2.156048 0.032395
H -3.765952 -2.188765 0.144406
H -5.054090 -0.027777 0.145341
H 2.845512 -1.973790 -0.484582