%chk=000079289.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079289

0 1
 O   0.5772000      -1.345600      -2.026900    
 N  -0.6745000      -2.192800      0.7381000    
 N   -1.770300      -2.348900       1.504500    
 C   -1.635300     -9.7000003E-02 -9.7000003E-03
 C    1.838100     -0.2067000     -0.3601000    
 C  -0.5879000      -1.105700     -5.7999999E-03
 C   0.6457000     -0.9135000     -0.8851000    
 C   -2.691800     -0.1917000     -0.9153000    
 C   -1.583400      0.9655000      0.8928000    
 C    2.113900     -0.2721000      0.9914000    
 C    2.639300      0.4970000      -1.237800    
 C   -3.696400      0.7760000     -0.9186000    
 C   -2.588200       1.932900      0.8897000    
 C    3.236300      0.3929000       1.485300    
 C    3.761800       1.161800     -0.7440000    
 C   -3.644800       1.838200     -1.6000001E-02
 C    4.060300       1.109700      0.6175000    
 H   -2.742300      -1.014900      -1.623400    
 H  -0.7670000       1.050100       1.605200    
 H    1.495500     -0.8289000       1.687500    
 H    2.415900      0.5485000      -2.299400    
 H   -4.519100      0.7024000      -1.623900    
 H   -2.548200       2.759700       1.592800    
 H    3.470000      0.3512000       2.545200    
 H    4.402800       1.720800      -1.419400    
 H   -4.427200       2.591400     -1.8300001E-02
 H    4.934300       1.627200       1.002000    
 H   -1.877400      -1.559400       2.139900    
 H   -1.652300      -3.176400       2.086600    


%chk=000079289-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079289

0 1
O 0.285159 0.862061 -1.696609
N -0.183853 -1.105621 1.204070
N -1.139790 -1.690205 1.966914
C -1.915562 0.326195 0.100307
C 2.036298 0.152199 -0.209601
C -0.515426 -0.168527 0.308057
C 0.585255 0.311834 -0.584526
C -2.552670 0.248406 -1.167062
C -2.634100 0.887315 1.194527
C 2.510065 0.108197 1.128894
C 2.978834 0.132850 -1.274171
C -3.876645 0.712631 -1.330608
C -3.956239 1.354889 1.026746
C 3.895377 0.039802 1.392235
C 4.360403 0.047688 -1.010388
C -4.583732 1.264603 -0.237420
C 4.824086 0.001032 0.326454
H -2.000367 -0.155728 -2.018617
H -2.141002 0.993455 2.168732
H 1.798663 0.135976 1.957112
H 2.602137 0.196640 -2.300291
H -4.352837 0.651581 -2.315472
H -4.489383 1.796649 1.876074
H 4.250748 0.017735 2.428590
H 5.075150 0.022985 -1.840448
H -5.608728 1.628202 -0.370788
H 5.898517 -0.058207 0.534815
H -2.141306 -1.485616 1.863995
H -0.824051 -2.457320 2.553278


