%chk=000080661.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080661

1 1
 O    1.815600     -0.4054000      1.0700000E-02
 N   -1.896400     -2.2100000E-02 -2.4999999E-03
 C  -0.5599000     -0.7492000      3.1800002E-02
 C   -1.973100      0.8398000      -1.254400    
 C   -3.027400      -1.040300     -1.7400000E-02
 C   -2.025200      0.8613000       1.230100    
 C   0.5639000      0.2681000      1.5300000E-02
 C    2.901200      0.5115000     -4.6999999E-03
 C    4.201400     -0.2638000     -8.9999996E-03
 H  -0.5251000      -1.371100      0.9344000    
 H  -0.5065000      -1.415000     -0.8381000    
 H   -1.682500      0.2347000      -2.118300    
 H   -3.009200       1.175400      -1.368800    
 H   -1.336600       1.721700      -1.148500    
 H   -2.952600      -1.652000      0.8866000    
 H   -3.981400     -0.5049000     -3.7300002E-02
 H   -2.920500      -1.661700     -0.9114000    
 H   -1.798100      0.2628000       2.117300    
 H   -1.359300       1.723700       1.149800    
 H   -3.057800       1.222500       1.279300    
 H   0.5369000      0.8945000     -0.8799000    
 H   0.5426000      0.9084000      0.9016000    
 H    2.845500       1.139600     -0.9009000    
 H    2.859100       1.153100      0.8826000    
 H    5.060300      0.4130000     -2.0800000E-02
 H    4.270100     -0.9064000      0.8750000    
 H    4.256500     -0.9197000     -0.8841000    


%chk=000080661-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080661

1 1
O 1.815752 -0.287431 0.001873
N -1.941979 0.027077 -0.008869
C -0.493900 -0.511241 0.003857
C -2.203991 0.854928 -1.267177
C -2.886612 -1.178034 -0.003929
C -2.217556 0.876357 1.232020
C 0.624382 0.546275 0.001945
C 3.082748 0.494883 0.009485
C 4.232348 -0.506133 0.007457
H -0.389408 -1.140123 0.904029
H -0.378428 -1.153139 -0.885768
H -1.946661 0.252499 -2.151615
H -3.269691 1.129120 -1.297588
H -1.589483 1.765927 -1.244571
H -2.700783 -1.775226 0.901407
H -3.927622 -0.820800 -0.010854
H -2.693309 -1.788280 -0.898938
H -1.975600 0.287257 2.129680
H -1.598287 1.783971 1.203171
H -3.282227 1.156037 1.243139
H 0.592425 1.193696 -0.902026
H 0.593395 1.195155 0.904848
H 3.107691 1.146218 -0.889541
H 3.102542 1.136796 0.915388
H 5.197861 0.029992 0.013387
H 4.191207 -1.153587 0.899360
H 4.196682 -1.143695 -0.891770


