%chk=000021325.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021325

0 1
 O    1.218900      -1.559600      -1.731300    
 O  -0.5378000      -2.730900     -0.1589000    
 O  -0.9593000       3.256600     -0.2872000    
 N   -1.199400      -1.345900       1.579200    
 N   -2.009600       1.474300      0.8425000    
 C   -3.599800     -0.8377000       1.515500    
 C   -2.523400      -1.902300       1.742000    
 C   -3.546400     -0.2652000      0.1296000    
 C    1.022200      -1.155300      0.6042000    
 C   -2.765700      0.8515000     -0.1537000    
 C    3.007300     -0.4190000     -0.5941000    
 C    3.532500      0.1043000      0.6114000    
 C    1.750600      -1.045900     -0.5807000    
 C  -0.2825000      -1.803100      0.6272000    
 C   -4.295500     -0.8746000     -0.8728000    
 C    1.538700     -0.6407000       1.789700    
 C    2.785600     -1.4800000E-02   1.794800    
 C   -2.733800       1.363500      -1.450700    
 C    3.754200     -0.3001000      -1.777400    
 C    4.789100      0.7311000      0.5981000    
 C   -4.263600     -0.3625000      -2.169900    
 C   -3.482800      0.7565000      -2.458900    
 C    5.001100      0.3258000      -1.772300    
 C    5.517500      0.8403000     -0.5868000    
 C   -1.181000       2.596400      0.7227000    
 C  -0.5372000       2.957300       2.037900    
 H   -3.555500     -5.8200002E-02   2.284000    
 H   -4.581600      -1.305600       1.671500    
 H   -2.664500      -2.749300       1.062200    
 H   -2.589000      -2.280200       2.767600    
 H  -0.9466000     -0.5918000       2.208100    
 H   -4.906000      -1.748700     -0.6628000    
 H    1.021300     -0.7325000       2.740300    
 H    3.173200      0.3744000       2.734000    
 H   -2.156100       2.223200      -1.758000    
 H    3.393900     -0.6677000      -2.734100    
 H    5.212300       1.140900       1.512900    
 H   -4.846000     -0.8357000      -2.955000    
 H   -2.058700       1.071600       1.771800    
 H   -3.458400       1.153800      -3.469600    
 H    5.567500      0.4150000      -2.694800    
 H    6.487800       1.328400     -0.5837000    
 H    1.927200      -1.882100      -2.310500    
 H   -1.288300       3.392600       2.702700    
 H   0.2608000       3.685900       1.870300    
 H  -0.1053000       2.069300       2.507800    


%chk=000021325-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021325

0 1
O 0.423271 -0.414360 -0.723268
O -0.277198 -2.209684 3.080836
O -0.147933 2.116388 -0.594303
N -1.176017 -1.682626 0.993437
N -2.149134 1.801117 0.570118
C -3.488202 -0.760209 1.366161
C -2.548909 -2.009704 1.369740
C -3.588588 -0.137386 -0.020540
C 1.234901 -1.357285 1.378224
C -2.865407 1.025231 -0.414135
C 2.812666 -0.241556 -0.184998
C 3.907365 -0.534115 0.715769
C 1.479540 -0.664232 0.173187
C -0.123835 -1.783388 1.885633
C -4.365421 -0.794031 -1.011180
C 2.344278 -1.644423 2.244820
C 3.638990 -1.248736 1.931354
C -2.891941 1.481298 -1.756675
C 3.081201 0.453828 -1.408859
C 5.227794 -0.103903 0.361543
C -4.402502 -0.344817 -2.346633
C -3.648899 0.791727 -2.723096
C 4.380223 0.860447 -1.725768
C 5.462394 0.583221 -0.832293
C -0.889724 2.348307 0.424138
C -0.407776 3.244673 1.551417
H -3.106162 -0.053533 2.124764
H -4.489902 -1.091031 1.701933
H -2.959063 -2.768330 0.674456
H -2.514358 -2.446921 2.382787
H -0.945842 -1.307478 0.058260
H -4.939633 -1.682712 -0.721629
H 2.109556 -2.173344 3.174084
H 4.469191 -1.476016 2.609653
H -2.319140 2.370382 -2.033146
H 2.257990 0.651098 -2.102074
H 6.055120 -0.325734 1.046241
H -5.008184 -0.876147 -3.088312
H -2.614089 1.947387 1.468702
H -3.661711 1.147564 -3.758605
H 4.575180 1.389048 -2.665245
H 6.476457 0.906983 -1.092114
H 0.262341 0.582286 -0.892502
H -0.156225 4.236635 1.138067
H 0.520886 2.823928 1.973650
H -1.145649 3.373450 2.361202


