%chk=000025416.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025416

0 1
 O    2.178200      0.4039000     -0.6015000    
 O   0.7404000      0.4241000       1.202100    
 N    5.714000     -0.1007000      0.3180000    
 C   -1.478900      0.8988000     -0.4971000    
 C   -2.339600     -0.1917000     -0.2902000    
 C  -0.1018000      0.7275000      -1.060400    
 C   -3.629400      3.7000000E-02  0.2456000    
 C    4.558100      0.1018000     -0.5426000    
 C    3.283600      0.1880000      0.2818000    
 C   -1.884100       2.195700     -0.1805000    
 C   -1.948700      -1.503700     -0.6033000    
 C   -4.020500       1.349000      0.5590000    
 C   0.9551000      0.5034000      9.9999997E-05
 C   -3.152300       2.420400      0.3469000    
 C   -4.490200      -1.053200      0.4528000    
 C   -2.817000      -2.574900     -0.3912000    
 C   -4.085500      -2.350100      0.1358000    
 C    6.947300     -0.1420000     -0.4718000    
 C    5.571200      -1.333300       1.096500    
 H  -5.4200001E-02 -7.1000002E-02  -1.806500    
 H   0.1756000       1.642700      -1.601600    
 H    4.459400     -0.6955000      -1.291900    
 H    4.665500       1.035700      -1.109700    
 H    3.342600       1.019000      0.9954000    
 H    3.081300     -0.7425000      0.8210000    
 H   -1.220600       3.042700     -0.3356000    
 H  -0.9675000      -1.744600      -1.000300    
 H   -5.007100       1.548000      0.9723000    
 H   -3.466800       3.430100      0.5943000    
 H   -5.485900     -0.9009000      0.8641000    
 H   -2.501600      -3.585600     -0.6337000    
 H   -4.760500      -3.184700      0.3017000    
 H    7.074700      0.7896000      -1.034500    
 H    6.955900     -0.9780000      -1.180700    
 H    7.821500     -0.2336000      0.1824000    
 H    6.505300      -1.560300       1.625000    
 H    5.326300      -2.198800      0.4699000    
 H    4.820500      -1.232800       1.886300    


%chk=000025416-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000025416

0 1
O 1.994343 1.267391 -1.248681
O 1.635031 2.270188 0.830329
N 4.612153 -0.932730 0.379231
C -1.273484 1.490937 -0.198007
C -1.561221 0.127123 -0.584541
C -0.160199 2.289964 -0.874256
C -2.641441 -0.577821 0.082666
C 3.273546 -0.542538 -0.116804
C 3.354537 0.835124 -0.802211
C -2.025962 2.092432 0.818028
C -0.823370 -0.566962 -1.603539
C -3.386575 0.081280 1.115193
C 1.222136 1.961018 -0.309057
C -3.081045 1.392031 1.479683
C -2.945043 -1.925650 -0.303157
C -1.145417 -1.879813 -1.957926
C -2.216351 -2.567664 -1.305552
C 4.850954 -2.389498 0.357955
C 4.940965 -0.335017 1.691184
H -0.147684 2.129391 -1.964463
H -0.328781 3.364544 -0.686320
H 2.508160 -0.507711 0.694851
H 2.932419 -1.288564 -0.856979
H 3.950859 0.784156 -1.724925
H 3.763120 1.600640 -0.120791
H -1.797561 3.122128 1.115549
H 0.013620 -0.066267 -2.099787
H -4.198599 -0.462088 1.613025
H -3.648355 1.894470 2.270461
H -3.765509 -2.445586 0.206107
H -0.573010 -2.389970 -2.740818
H -2.458414 -3.596434 -1.594152
H 4.684574 -2.782775 -0.660442
H 4.196444 -2.960586 1.063766
H 5.901801 -2.592804 0.633247
H 6.004420 -0.519836 1.926679
H 4.320348 -0.749419 2.524767
H 4.782892 0.756415 1.667587


