%chk=000129826.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129826

0 1
 O   -5.721100     -0.4509000      0.1606000    
 O    6.039000     -4.6599999E-02  0.4633000    
 N   -3.678300      0.6623000     -2.6500000E-02
 N    2.759000       1.285100      0.2683000    
 N    4.106500       1.179200      0.3247000    
 C    2.709800      -1.094200     -0.3849000    
 C   -1.628300     -0.6564000      0.2464000    
 C   -2.466800      -1.837400      0.6378000    
 C   -2.247100      0.5714000     -4.8500001E-02
 C    2.055700      0.2322000     -2.3499999E-02
 C   0.5604000      0.3490000     -3.5100002E-02
 C   -3.782200      -1.800900     -0.1109000    
 C    3.973300      -1.246600      0.4471000    
 C  -0.2296000     -0.7585000      0.2599000    
 C   -4.493000     -0.4745000      5.4800000E-02
 C   -1.434500       1.681400     -0.3305000    
 C  -4.1800000E-02   1.567500     -0.3293000    
 C    3.011900      -1.142700      -1.884000    
 C    4.811700      5.0000002E-04  0.3904000    
 C   -4.304500       1.980100     -8.0100000E-02
 H    2.068100      -1.945700     -0.1556000    
 H   -1.949300      -2.776200      0.4098000    
 H   -2.639300      -1.800400       1.720200    
 H   -4.435500      -2.601100      0.2544000    
 H   -3.625700      -1.960300      -1.185000    
 H    4.569400      -2.098300      0.1020000    
 H    3.716200      -1.416900       1.499700    
 H   0.2045000      -1.710300      0.5476000    
 H   -1.857800       2.653400     -0.5670000    
 H   0.5513000       2.447100     -0.5658000    
 H    2.084400      -1.077600      -2.463500    
 H    3.650700     -0.3121000      -2.202400    
 H    3.511100      -2.079700      -2.151700    
 H   -4.116400       2.429900      -1.059900    
 H   -3.902700       2.612100      0.7180000    
 H   -5.387600       1.911700      5.5799998E-02
 H    4.595200       2.067800      0.3667000    


%chk=000129826-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129826

0 1
O -5.801886 -0.289645 -0.160496
O 6.210812 0.299188 0.050098
N -3.689588 0.684252 0.078426
N 2.742548 1.380124 -0.242153
N 4.142348 1.292699 -0.299945
C 2.779725 -1.109537 -0.044159
C -1.647786 -0.705426 0.094052
C -2.540396 -1.922819 0.248249
C -2.266611 0.577426 0.025472
C 2.066723 0.244990 -0.085344
C 0.589674 0.349305 -0.036482
C -3.848398 -1.722615 -0.543290
C 4.157876 -0.957379 0.648144
C -0.244681 -0.800081 0.053284
C -4.542549 -0.410273 -0.186516
C -1.446474 1.735882 -0.058971
C -0.048633 1.620980 -0.088980
C 2.922363 -1.667139 -1.489914
C 4.950494 0.223954 0.103319
C -4.315938 1.998822 0.328390
H 2.185105 -1.827621 0.547431
H -2.021133 -2.836992 -0.089933
H -2.785766 -2.071846 1.320455
H -4.573375 -2.532004 -0.360445
H -3.634714 -1.708079 -1.631068
H 4.768953 -1.867479 0.529804
H 4.025163 -0.788833 1.736069
H 0.195960 -1.802376 0.101498
H -1.897244 2.730832 -0.107585
H 0.577428 2.514635 -0.158799
H 1.935933 -1.773070 -1.974162
H 3.536686 -0.995341 -2.116234
H 3.410425 -2.658750 -1.471687
H -4.166747 2.683617 -0.526867
H -3.894861 2.457147 1.239581
H -5.395292 1.829800 0.457689
H 4.600556 2.167053 -0.565633


