%chk=000064475.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064475

0 1
 O   0.8573000      -1.485600      0.8447000    
 N    2.718100      0.2173000     -0.3018000    
 C  -0.7996000      0.2376000       1.238200    
 C   -2.118600     -0.5160000      0.8189000    
 C   0.4129000     -0.2069000      0.3736000    
 C  -9.9399999E-02 -0.3081000      -1.082100    
 C   -1.840100       1.533200     -0.4262000    
 C   -1.153800       1.695400      0.9269000    
 C   -2.892400      0.4899000     -6.2500000E-02
 C  -0.8461000      0.9995000      -1.488600    
 C   -1.872300      -1.798800      2.4599999E-02
 C   -1.020300      -1.542700      -1.225300    
 C    1.638600      0.7087000      0.4947000    
 C    3.128200      -1.137200      0.1125000    
 C    3.887600       1.113600     -0.2475000    
 H  -0.5956000      8.9000002E-02   2.304200    
 H   -2.714800     -0.7486000       1.709500    
 H   0.7206000     -0.4609000      -1.793900    
 H   -2.299500       2.466000     -0.7675000    
 H  -0.3185000       2.395200      0.9081000    
 H   -1.860300       2.080000       1.674700    
 H   -3.369800      4.2599998E-02 -0.9404000    
 H   -3.688100      0.9560000      0.5329000    
 H  -9.9699996E-02   1.780900      -1.680000    
 H   -1.374400      0.8448000      -2.437400    
 H   -2.823900      -2.256600     -0.2725000    
 H   -1.380100      -2.536500      0.6694000    
 H  -0.4107000      -2.435600      -1.414200    
 H   -1.665900      -1.433000      -2.105100    
 H    1.934000      0.7896000       1.550100    
 H    1.404800       1.719800      0.1520000    
 H   0.9714000      -1.428600       1.809000    
 H    3.188600      -1.268800       1.199100    
 H    4.144500      -1.338000     -0.2564000    
 H    2.549700      -1.920400     -0.3879000    
 H    3.611600       2.122200     -0.5749000    
 H    4.671300      0.7685000     -0.9310000    
 H    4.305800       1.179300      0.7635000    


%chk=000064475-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064475

0 1
O 0.634014 -1.737614 0.927132
N 2.746944 0.192070 -0.249238
C -0.884945 0.211393 1.281100
C -2.243173 -0.455741 0.785783
C 0.342396 -0.341478 0.475542
C -0.099563 -0.428919 -1.005098
C -1.720676 1.586790 -0.476244
C -1.123159 1.713136 0.948690
C -2.884324 0.607347 -0.181680
C -0.675096 0.961708 -1.447635
C -2.042685 -1.797215 0.042120
C -1.104582 -1.607893 -1.186711
C 1.639511 0.499048 0.682293
C 3.440672 -1.090189 -0.002742
C 3.703207 1.311868 -0.364154
H -0.720420 0.040614 2.364214
H -2.898495 -0.617430 1.662924
H 0.795651 -0.620684 -1.624833
H -2.071401 2.554861 -0.881565
H -0.227347 2.352801 1.012977
H -1.876920 2.140392 1.638966
H -3.291306 0.134098 -1.093485
H -3.714704 1.148249 0.311208
H 0.165585 1.674280 -1.572749
H -1.134000 0.841357 -2.449006
H -3.030234 -2.182004 -0.281623
H -1.599347 -2.541896 0.723508
H -0.537199 -2.541008 -1.349317
H -1.694092 -1.426169 -2.107263
H 1.949609 0.389408 1.760218
H 1.408247 1.566306 0.537577
H 0.888393 -1.688534 1.885148
H 3.989266 -1.102300 0.975384
H 4.178079 -1.265929 -0.807380
H 2.709117 -1.911239 0.001490
H 3.173613 2.235140 -0.661372
H 4.448151 1.079729 -1.146968
H 4.262311 1.522446 0.584192


