%chk=000026999.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026999

0 1
 O   -2.723900       1.485200      0.3817000    
 O    1.854600       1.691000      0.1458000    
 N    3.416200     -1.2200000E-02 -5.2200001E-02
 N  -0.2783000      0.1108000      0.1591000    
 C    3.699300      -1.438000     -0.1610000    
 C    4.590400      0.8572000     -6.0899999E-02
 C    2.113400      0.4879000      5.2900001E-02
 C    1.002100     -0.5452000      4.6200000E-02
 C   -1.489300     -0.5632000      0.1821000    
 C    3.728800      -1.889100      -1.606700    
 C    5.114500       1.095800       1.340200    
 C   -2.712700      0.1252000      0.2933000    
 C   -1.522600      -1.967800      9.3000002E-02
 C   -3.924200     -0.5658000      0.3146000    
 C   -2.734100      -2.658700      0.1143000    
 C   -3.934900      -1.957800      0.2251000    
 C   -3.423000       2.194600     -0.6387000    
 C   -2.776100       3.550100     -0.8287000    
 H    4.665900      -1.645400      0.3127000    
 H    2.964900      -2.029500      0.3898000    
 H    4.304300       1.820200     -0.4987000    
 H    5.366000      0.4244000     -0.7016000    
 H    1.046200      -1.112800     -0.8865000    
 H    1.138000      -1.203700      0.9099000    
 H  -0.3081000       1.122700      0.2230000    
 H    2.785700      -1.689700      -2.122600    
 H    4.519200      -1.374400      -2.163200    
 H    3.925400      -2.964400      -1.663500    
 H    4.348200       1.552500       1.975500    
 H    5.423100      0.1586000       1.814400    
 H    5.979700       1.765400       1.314600    
 H  -0.6130000      -2.556200      5.7000001E-03
 H   -4.867400     -3.4800000E-02  0.4092000    
 H   -2.743000      -3.742600      4.5200001E-02
 H   -4.878100      -2.496200      0.2437000    
 H   -3.395500       1.646200      -1.588600    
 H   -4.467300       2.320800     -0.3333000    
 H   -1.725900       3.438100      -1.118100    
 H   -2.789200       4.118400      0.1071000    
 H   -3.295300       4.126900      -1.599200    


%chk=000026999-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000026999

0 1
O -2.403703 1.487497 -0.284544
O 1.888087 1.582253 -0.152008
N 3.469905 -0.122444 -0.088136
N -0.231426 -0.029895 -0.092344
C 3.846613 -1.552338 -0.025915
C 4.568323 0.873713 -0.167501
C 2.166318 0.340846 -0.081170
C 1.038450 -0.709178 0.020353
C -1.454366 -0.682850 -0.042520
C 4.104411 -2.176289 -1.416379
C 5.046942 1.334728 1.225387
C -2.651847 0.104701 -0.147039
C -1.593973 -2.089194 0.104769
C -3.922775 -0.494733 -0.108666
C -2.875676 -2.689976 0.143209
C -4.039372 -1.902960 0.037058
C -3.563519 2.387087 -0.384915
C -3.017193 3.807684 -0.506874
H 4.759070 -1.632586 0.595610
H 3.061633 -2.118449 0.503901
H 4.190729 1.740481 -0.735429
H 5.401102 0.420002 -0.736951
H 1.166799 -1.476546 -0.776518
H 1.130243 -1.251485 0.991734
H -0.199242 0.991542 -0.174378
H 3.195503 -2.140822 -2.042583
H 4.906959 -1.637922 -1.951637
H 4.412723 -3.232865 -1.312625
H 4.221973 1.829628 1.765160
H 5.406558 0.484793 1.834518
H 5.877288 2.057566 1.124560
H -0.700557 -2.716871 0.190037
H -4.827179 0.116421 -0.190032
H -2.955929 -3.777018 0.256751
H -5.031130 -2.365968 0.066261
H -4.168774 2.109410 -1.273091
H -4.196382 2.274404 0.520132
H -2.384962 3.906141 -1.405761
H -2.406779 4.066272 0.375151
H -3.850844 4.529721 -0.581976


