%chk=000154719.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154719

0 1
 O   -2.819400      -2.198400      -1.098300    
 O   -2.818800      -2.199800       1.096900    
 O    4.359400      0.5490000      -1.097300    
 O    4.359100      0.5470000       1.098000    
 N   -2.697600      -1.606000     -3.0000001E-04
 N    3.827000      0.2701000      9.9999997E-05
 C   -1.120000      0.3723000      1.9999999E-04
 C   0.1077000     -0.3800000      9.9999997E-05
 C    1.345500      0.3147000     -3.9999999E-04
 C   -1.062800       1.790600      9.9999997E-05
 C   -2.411400     -0.2124000      5.0000002E-04
 C    1.361000       1.711800     -5.0000002E-04
 C   0.1749000       2.438700     -1.9999999E-04
 C    2.561400     -0.3902000     -6.0000003E-04
 C   0.1731000      -1.796000      3.9999999E-04
 C   -2.242700       2.553900      3.0000001E-04
 C   -3.577000      0.5585000      5.0000002E-04
 C    2.583800      -1.781500     -3.0000001E-04
 C    1.389100      -2.484700      3.9999999E-04
 C   -3.492400       1.942200      5.0000002E-04
 H    2.286700       2.282600     -8.9999998E-04
 H   0.2325000       3.525700     -3.0000001E-04
 H  -0.6649000      -2.466900      7.9999998E-04
 H   -2.197900       3.641600      1.9999999E-04
 H   -4.562600      9.7300000E-02  6.0000003E-04
 H    3.522700      -2.329600     -1.9999999E-04
 H    1.398600      -3.571000      6.9999998E-04
 H   -4.394900       2.545800      5.0000002E-04


%chk=000154719-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154719

0 1
O -2.885682 -2.240576 -1.143217
O -2.886362 -2.240843 1.142680
O 4.386761 0.619588 -1.143688
O 4.390635 0.613216 1.143229
N -2.751236 -1.660315 -0.000163
N 3.876625 0.315346 -0.000195
C -1.141020 0.340543 0.000086
C 0.118380 -0.426317 0.000081
C 1.367671 0.307690 -0.000147
C -1.076951 1.789064 0.000075
C -2.470799 -0.196239 0.000084
C 1.382835 1.751398 -0.000264
C 0.202381 2.458229 -0.000083
C 2.588182 -0.433570 -0.000085
C 0.193889 -1.856806 0.000331
C -2.262145 2.586352 0.000181
C -3.632774 0.587501 0.000189
C 2.646781 -1.825219 0.000205
C 1.419815 -2.536437 0.000370
C -3.530269 2.000920 0.000258
H 2.338881 2.283018 -0.000533
H 0.211145 3.553430 -0.000130
H -0.699025 -2.476295 0.000595
H -2.157003 3.676570 0.000183
H -4.612085 0.099521 0.000186
H 3.607174 -2.348528 0.000360
H 1.430107 -3.630183 0.000571
H -4.435811 2.614242 0.000338


