%chk=000046153.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046153

0 1
 O   -1.490900       1.090900      9.9999997E-05
 O   -3.718500      0.5573000      1.9999999E-04
 N    3.859600     -0.5246000      1.9999999E-04
 C   0.1551000     -0.7022000     -1.9999999E-04
 C  -0.1497000      0.6564000       0.000000    
 C    1.495900      -1.093200     -3.0000001E-04
 C    2.505500     -0.1264000       0.000000    
 C   0.8461000       1.631000       0.000000    
 C  -0.9335000      -1.664500      9.9999997E-05
 C    2.181000       1.232300       0.000000    
 C   -2.201300      -1.245000      1.9999999E-04
 C   -2.549400      0.1881000     -3.9999999E-04
 H    1.757000      -2.149600     -3.0000001E-04
 H   0.5924000       2.686600       0.000000    
 H  -0.7003000      -2.723600      3.9999999E-04
 H    2.962100       1.988300      9.9999997E-05
 H   -3.019100      -1.957400      5.0000002E-04
 H    4.098100      -1.507400      1.9999999E-04
 H    4.592100      0.1727000      3.9999999E-04


%chk=000046153-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000046153

0 1
O -1.502486 1.097839 -0.000059
O -3.766001 0.644341 0.000346
N 3.902906 -0.512419 0.000091
C 0.160436 -0.731016 0.000032
C -0.169721 0.656025 0.000001
C 1.527006 -1.117685 0.000074
C 2.556875 -0.145909 0.000064
C 0.843995 1.636190 0.000015
C -0.936880 -1.677798 0.000075
C 2.190008 1.240186 0.000037
C -2.246488 -1.252830 0.000055
C -2.613402 0.164492 -0.000253
H 1.776946 -2.186070 0.000117
H 0.562520 2.693089 -0.000004
H -0.710450 -2.750860 0.000197
H 2.977411 2.003257 0.000039
H -3.085418 -1.953347 0.000172
H 4.180235 -1.489255 0.000115
H 4.634709 0.191471 0.000085


