%chk=000030691.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030691

0 1
 O    2.661900      0.9676000      0.8987000    
 O   -2.106300       2.041300      0.5644000    
 O   0.5357000      -1.901000     -0.1481000    
 N   0.4159000      0.8194000      0.5162000    
 N    2.014500      0.1242000      -1.121300    
 C  -0.7560000      8.8299997E-02  0.2156000    
 C    3.855000      0.4701000      0.3142000    
 C    3.478300      0.2015000      -1.121400    
 C    1.671500      0.6114000      3.0700000E-02
 C   -1.999300      0.7198000      0.2475000    
 C  -0.6692000      -1.264800     -0.1124000    
 C   -3.155900     -1.7000000E-03 -4.8599999E-02
 C   -1.825900      -1.986200     -0.4083000    
 C   -3.069200      -1.354500     -0.3765000    
 C   -2.034000       2.973100     -0.5125000    
 C   0.9830000      -2.508500       1.061900    
 H    4.150600     -0.4435000      0.8407000    
 H    4.658800       1.206700      0.4011000    
 H    3.797800       1.020300      -1.775300    
 H    3.929700     -0.7247000      -1.489300    
 H   0.2973000       1.490200       1.270100    
 H   -4.128100      0.4834000     -2.5300000E-02
 H   -1.766200      -3.040300     -0.6651000    
 H   -3.969700      -1.916300     -0.6070000    
 H   -1.077700       2.886200      -1.037800    
 H   -2.861700       2.815200      -1.211300    
 H   -2.114200       3.981800     -9.8399997E-02
 H   0.3367000      -3.352500       1.322400    
 H    1.002200      -1.785300       1.883400    
 H    1.998300      -2.881700      0.9022000    


%chk=000030691-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030691

0 1
O 2.787453 1.106788 0.803111
O -1.427402 2.026843 0.338889
O 0.094311 -2.617213 0.195084
N 0.575705 0.369160 0.748649
N 2.189042 -0.399357 -0.903110
C -0.615260 -0.201884 0.204358
C 4.019217 0.972622 -0.037768
C 3.655465 -0.152441 -1.070614
C 1.812063 0.297950 0.135031
C -1.695412 0.699263 -0.056303
C -0.803357 -1.583018 -0.083620
C -2.896229 0.270613 -0.654597
C -1.996069 -2.007611 -0.728608
C -3.021561 -1.093449 -1.014762
C -2.463368 3.029536 0.088349
C 0.928178 -2.556172 1.405948
H 4.851753 0.712910 0.635396
H 4.206237 1.950845 -0.513622
H 3.865921 0.159371 -2.108346
H 4.214199 -1.087701 -0.877419
H 0.433970 1.210303 1.315126
H -3.711754 0.970479 -0.854950
H -2.093015 -3.071957 -0.959922
H -3.939879 -1.442683 -1.498398
H -2.679212 3.115952 -0.993766
H -3.395173 2.789137 0.635953
H -2.045460 3.976256 0.461216
H 0.369879 -2.123311 2.256228
H 1.847163 -1.975830 1.224929
H 1.186396 -3.605903 1.618037


