%chk=000096299.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096299

0 1
 O    4.267100      -1.760100     -2.4000001E-03
 N    3.806700      0.5519000      5.0000002E-04
 N   -5.709000     -0.9174000       0.000000    
 C  -0.7249000      -1.595900      3.0000001E-04
 C   0.2907000     -0.4725000     -9.9999997E-05
 C   -2.031800     -0.8305000      9.9999997E-05
 C  -0.3595000      0.7822000     -3.9999999E-04
 C   -1.789700      0.5617000     -1.9999999E-04
 C    1.671000     -0.5715000      9.9999997E-05
 C   0.3760000       1.955600     -3.9999999E-04
 C   -3.318100      -1.340800      3.9999999E-04
 C   -2.844400       1.459100     -1.9999999E-04
 C    2.412000      0.6115000     -1.9999999E-04
 C    1.771100       1.862500     -5.0000002E-04
 C   -4.381100     -0.4359000      3.9999999E-04
 C   -4.146700      0.9500000      1.9999999E-04
 C    4.623300     -0.5863000      8.9999998E-04
 C    6.087200     -0.2235000      1.5000000E-03
 H  -0.6314000      -2.202600      0.9056000    
 H  -0.6314000      -2.203100     -0.9047000    
 H    2.091000      -1.565900      7.9999998E-04
 H  -0.1045000       2.928200     -6.0000003E-04
 H   -3.487700      -2.412700      5.0000002E-04
 H   -2.679300       2.531300     -3.9999999E-04
 H    2.357400       2.779000     -6.0000003E-04
 H   -4.983000       1.645800      9.9999997E-05
 H    4.280000       1.453200      7.9999998E-04
 H   -5.885800      -1.913200      1.1000000E-03
 H   -6.483000     -0.2665000      1.0000000E-03
 H    6.328900      0.3382000     -0.9052000    
 H    6.694400      -1.132500      2.9200001E-02
 H    6.318800      0.3841000      0.8809000    


%chk=000096299-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096299

0 1
O 4.369143 -1.758736 0.003918
N 3.878311 0.540096 0.002843
N -5.816332 -0.890769 -0.001489
C -0.778079 -1.620396 0.000605
C 0.271206 -0.512493 0.001138
C -2.094322 -0.848178 0.000114
C -0.374151 0.762787 0.001017
C -1.830595 0.557061 0.000374
C 1.667665 -0.636973 0.001745
C 0.410133 1.938621 0.001518
C -3.405054 -1.341944 -0.000480
C -2.910918 1.467839 0.000027
C 2.450978 0.552730 0.002243
C 1.815216 1.826922 0.002158
C -4.499181 -0.422818 -0.000828
C -4.233255 0.981072 -0.000572
C 4.750320 -0.550451 0.002453
C 6.229221 -0.152521 -0.002045
H -0.681917 -2.276466 0.887901
H -0.681178 -2.276317 -0.886721
H 2.170100 -1.606111 0.002058
H -0.056292 2.929925 0.001421
H -3.600836 -2.421824 -0.000679
H -2.734146 2.549719 0.000222
H 2.430550 2.736851 0.002554
H -5.075435 1.684414 -0.000855
H 4.318176 1.463739 0.002794
H -6.015350 -1.886452 -0.001356
H -6.598531 -0.243335 -0.001411
H 6.489833 0.411910 -0.916860
H 6.836381 -1.068433 0.031192
H 6.482639 0.473930 0.873500


