%chk=000029489.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029489

0 1
 O    1.180900      0.6173000      0.9680000    
 O    1.878400      9.7800002E-02  -1.189100    
 O    4.631900      -1.756200     -0.1811000    
 N    3.371700      5.0500002E-02  0.5840000    
 C   -3.241700      -1.145300     -0.1332000    
 C   -2.269200     -1.6700000E-02 -7.1400002E-02
 C   -3.573800      -1.713600       1.259600    
 C   -2.768900      -2.280500      -1.061100    
 C  -0.9836000     -0.2303000      0.4261000    
 C   -2.644700       1.252500     -0.5118000    
 C  -7.3600002E-02  0.8254000      0.4832000    
 C   -1.734800       2.308100     -0.4548000    
 C  -0.4493000       2.094500      4.2599998E-02
 C    2.134000      0.2388000      3.1999999E-03
 C    4.542600     -0.3424000     -0.1642000    
 H   -4.187900     -0.7756000     -0.5516000    
 H   -2.701700      -2.180000       1.730400    
 H   -4.359400      -2.473500       1.186600    
 H   -3.932500     -0.9223000       1.927200    
 H   -2.548400      -1.897000      -2.063500    
 H   -3.546300      -3.046200      -1.157400    
 H   -1.864700      -2.769300     -0.6826000    
 H  -0.6762000      -1.213400      0.7735000    
 H   -3.641900       1.436400     -0.9024000    
 H   -2.027000       3.296300     -0.7977000    
 H   0.2546000       2.921400      8.4600002E-02
 H    3.458600      0.1776000       1.587500    
 H    5.427000      7.1500003E-02  0.3274000    
 H    4.482700      2.4000000E-02  -1.192500    
 H    4.520300      -2.054800      0.7373000    


%chk=000029489-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000029489

0 1
O 1.347057 0.928414 0.130537
O 1.673151 -1.418706 -0.167375
O 4.865672 -1.337105 1.465173
N 3.443256 0.109344 0.076449
C -3.290156 -1.121488 -0.165865
C -2.341762 0.078484 -0.081797
C -3.169517 -2.037440 1.081513
C -3.065410 -1.933922 -1.469509
C -0.937319 -0.127737 -0.021136
C -2.848909 1.400509 -0.065816
C -0.079256 0.989436 0.048841
C -1.972431 2.508670 0.008631
C -0.579065 2.311352 0.065972
C 2.108269 -0.258432 0.000593
C 4.509545 -0.882028 0.118102
H -4.325071 -0.723996 -0.191456
H -2.160297 -2.483471 1.151515
H -3.901054 -2.864882 1.024491
H -3.355297 -1.472344 2.012690
H -3.188008 -1.296894 -2.364041
H -3.788072 -2.768692 -1.534880
H -2.047487 -2.364604 -1.497496
H -0.517470 -1.134886 -0.033063
H -3.932315 1.562897 -0.111470
H -2.374181 3.527783 0.021652
H 0.121330 3.149687 0.123674
H 3.642662 1.103667 0.195760
H 5.391204 -0.463734 -0.406342
H 4.155330 -1.791631 -0.387145
H 5.272701 -0.593248 1.978598


