%chk=000080672.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080672

0 1
 O   -1.249900      -1.125800      0.2425000    
 O  -0.8316000       1.162900     -0.1717000    
 N    3.851600      -1.158300     -0.8910000    
 C   0.7653000     -0.1634000       1.112400    
 C  -0.7104000      9.4400004E-02  0.7710000    
 C    1.616800     -0.5112000     -0.1164000    
 C    3.061400     -0.8104000      0.2842000    
 C   -2.621400      -1.002700     -0.1106000    
 C  -0.2968000       2.391200      0.3018000    
 C   -3.110700      -2.327000     -0.6568000    
 C  -0.4743000       3.450300     -0.7653000    
 H    1.210200      0.6784000       1.652000    
 H   0.8060000      -1.018400       1.800900    
 H   -1.260400      0.3490000       1.685800    
 H    1.600100      0.3193000     -0.8322000    
 H    1.190600      -1.383800     -0.6267000    
 H    3.506600      6.5399997E-02  0.7681000    
 H    3.093000      -1.639700      0.9994000    
 H   -3.206500     -0.7269000      0.7735000    
 H   -2.749400     -0.2311000     -0.8773000    
 H  -0.8150000       2.692300       1.218500    
 H   0.7748000       2.315500      0.5012000    
 H    3.462700      -1.990500      -1.332400    
 H    4.797300      -1.404000     -0.6014000    
 H   -4.166000      -2.268500     -0.9377000    
 H   -2.526900      -2.621200      -1.535300    
 H   -2.986800      -3.120500      8.7600000E-02
 H  -7.6099999E-02   4.412900     -0.4323000    
 H   3.5900000E-02   3.157000      -1.688800    
 H   -1.533900       3.573600      -1.012900    


%chk=000080672-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080672

0 1
O -1.154874 -1.044690 0.178936
O -0.618141 1.208131 -0.255744
N 3.982357 -1.457939 -0.861379
C 0.904660 -0.235126 1.117073
C -0.541996 0.123703 0.748176
C 1.759628 -0.672040 -0.090815
C 3.193105 -1.057256 0.322637
C -2.596297 -0.883518 -0.111075
C -0.528161 2.557802 0.321712
C -3.094262 -2.214128 -0.672005
C -0.795016 3.556488 -0.805156
H 1.366381 0.645604 1.608283
H 0.868049 -1.043453 1.874371
H -1.112637 0.462874 1.652429
H 1.803834 0.140466 -0.837830
H 1.266122 -1.533164 -0.582271
H 3.689442 -0.179201 0.782514
H 3.135955 -1.845493 1.116297
H -3.128400 -0.617279 0.829996
H -2.728006 -0.057560 -0.834715
H -1.276204 2.668791 1.139753
H 0.480939 2.723682 0.757657
H 3.551684 -2.218958 -1.397469
H 4.972451 -1.640924 -0.669771
H -4.173544 -2.153977 -0.903747
H -2.551033 -2.466041 -1.599077
H -2.935457 -3.029772 0.054656
H -0.729174 4.593521 -0.427882
H -0.054512 3.428849 -1.613322
H -1.800693 3.399408 -1.232133


