%chk=000096429.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096429

0 1
 O    2.446700     -0.4216000      9.9999997E-05
 O   -2.845300     -0.3389000     -3.0000001E-04
 N  -0.8384000      0.8356000      3.9999999E-04
 N   0.5299000      0.8234000      9.9999997E-05
 C   -1.614700     -0.3171000      5.0000002E-04
 C    1.097400     -0.3318000     -3.0000001E-04
 C  -0.8852000      -1.607700      9.9999997E-05
 C   0.4458000      -1.637600     -1.9999999E-04
 C   -1.436900       2.159500     -3.0000001E-04
 C    3.100600      0.8364000       0.000000    
 H    1.019100      -2.554200     -3.9999999E-04
 H   -1.467500      -2.521900      9.9999997E-05
 H   -1.104700       2.696600      0.8930000    
 H   -2.528300       2.102800      6.9999998E-04
 H   -1.106400       2.694900     -0.8952000    
 H    2.864800       1.408000      0.9041000    
 H    2.864600       1.407900     -0.9041000    
 H    4.179300      0.6516000     -9.9999997E-05


%chk=000096429-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096429

0 1
O 2.517929 -0.421802 0.000027
O -2.962733 -0.263251 -0.000293
N -0.865392 0.814228 -0.000006
N 0.523261 0.822291 -0.000068
C -1.691940 -0.350738 0.000087
C 1.131911 -0.364379 -0.000055
C -0.936963 -1.610338 0.000064
C 0.439483 -1.629646 0.000021
C -1.481013 2.151823 -0.000289
C 3.230039 0.868476 -0.000064
H 1.025155 -2.553135 0.000035
H -1.538170 -2.523699 0.000099
H -1.166017 2.709980 0.897389
H -2.572617 2.014496 0.000746
H -1.167723 2.708930 -0.899236
H 2.970041 1.457228 0.897665
H 2.969732 1.457276 -0.897672
H 4.295819 0.598160 -0.000248


