%chk=000028916.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028916

0 1
 O    5.830500      0.1494000      2.2800000E-02
 O   -2.338000      -1.661600      0.2527000    
 O    1.057400      0.4790000       1.275600    
 O  -0.2377000      -2.510100     -2.7600000E-02
 N    3.033900      0.4934000      5.7399999E-02
 C    3.852300      0.9039000       1.198400    
 C    3.762200      0.4298000      -1.214100    
 C    5.125400      7.2499998E-02   1.264500    
 C    5.043100     -0.3781000      -1.048200    
 C    1.661200      0.3136000      0.2127000    
 C   0.8961000     -0.1148000      -1.013900    
 C  -0.5447000     -0.2306000     -0.6185000    
 C   -1.397000      0.7993000     -0.7068000    
 C   -2.788700      0.6559000     -0.3149000    
 C  -0.9999000      -1.553000     -0.1163000    
 C   -3.228200     -0.5753000      0.1576000    
 C   -3.699700       1.711600     -0.3957000    
 C   -4.548800     -0.7816000      0.5512000    
 C   -5.028100       1.520500     -4.6000001E-03
 C   -5.451400      0.2762000      0.4678000    
 H    3.293100      0.8213000       2.135200    
 H    4.097900       1.960600       1.040500    
 H    4.002700       1.465500      -1.481800    
 H    3.158500      7.1999999E-03  -2.018600    
 H    5.784400      0.4550000       2.050000    
 H    4.906400     -0.9777000       1.491300    
 H    4.825600      -1.434400     -0.8500000    
 H    5.641700     -0.3252000      -1.962900    
 H    1.013300      0.6451000      -1.795200    
 H    1.286300      -1.062600      -1.397600    
 H   -1.067500       1.767000      -1.071900    
 H   -3.390400       2.688000     -0.7604000    
 H   -4.876000      -1.749600      0.9181000    
 H   -5.734200       2.343500     -6.8400003E-02
 H   -6.484900      0.1340000      0.7701000    


%chk=000028916-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028916

0 1
O 4.596128 -1.006157 1.135218
O -1.561710 -1.532581 -0.735567
O 1.704077 2.711783 -0.214637
O 0.464532 -1.763585 -1.789933
N 3.051819 0.830755 -0.470186
C 4.012202 1.333606 0.543887
C 3.401276 -0.509740 -0.999614
C 4.176191 0.299731 1.672875
C 3.596665 -1.496216 0.173097
C 1.951266 1.604581 -0.797026
C 0.983829 1.116698 -1.901104
C -0.267347 0.504867 -1.297671
C -1.252186 1.274546 -0.707529
C -2.427421 0.681223 -0.108993
C -0.375394 -0.961825 -1.318632
C -2.555867 -0.738184 -0.146595
C -3.466137 1.433521 0.510828
C -3.671880 -1.401839 0.401606
C -4.583263 0.785303 1.063247
C -4.685210 -0.632301 1.006333
H 3.628996 2.293319 0.928100
H 4.991451 1.500846 0.053209
H 4.346090 -0.432820 -1.574220
H 2.605420 -0.901170 -1.651103
H 4.973904 0.602672 2.370548
H 3.219546 0.189868 2.227827
H 2.624459 -1.661999 0.685248
H 3.983826 -2.459931 -0.194590
H 0.712274 2.030993 -2.455587
H 1.448552 0.410487 -2.604774
H -1.128101 2.363303 -0.679448
H -3.378694 2.525233 0.550842
H -3.726569 -2.492717 0.347342
H -5.377664 1.369166 1.538587
H -5.558264 -1.133736 1.436915


