%chk=000019002.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019002

0 1
 O  -0.9478000     -0.9011000     -0.9323000    
 O    4.722800       1.333100      0.4014000    
 O    5.296000     -0.8963000      0.4146000    
 N   -4.204400      0.2853000      0.3218000    
 C   -3.213300     -0.6515000     -0.2064000    
 C   -4.406400       1.394700     -0.6092000    
 C   -5.469400     -0.4014000      0.5808000    
 C   -1.883000      4.7899999E-02 -0.4366000    
 C   -5.388100       2.409900     -4.8999999E-02
 C   -5.278300      -1.558100       1.547200    
 C   0.3719000     -0.6813000     -0.6354000    
 C    1.236500      -1.761800     -0.5033000    
 C   0.8326000      0.6200000     -0.4712000    
 C    3.049900     -0.2354000     -3.5999998E-02
 C    2.580000      -1.538100     -0.2024000    
 C    2.176200      0.8437000     -0.1704000    
 C    4.450700     -2.0000001E-03  0.2774000    
 C    6.074200       1.692200      0.7090000    
 H   -3.006000      -1.466500      0.4958000    
 H   -3.552000      -1.124500      -1.138100    
 H   -3.485500       1.965600     -0.7540000    
 H   -4.745500       1.051200      -1.594500    
 H   -6.182200      0.2739000       1.065300    
 H   -5.934700     -0.7672000     -0.3432000    
 H   -1.553900      0.4860000      0.5154000    
 H   -1.949500      0.8249000      -1.202100    
 H   -6.423500       2.058300     -9.1399997E-02
 H   -5.146300       2.682400      0.9841000    
 H   -5.347600       3.328400     -0.6458000    
 H   -6.255700      -1.893900       1.912300    
 H   -4.688600      -1.265400       2.422700    
 H   -4.810900      -2.427200       1.074200    
 H   0.8742000      -2.777800     -0.6322000    
 H   0.1930000       1.488500     -0.5955000    
 H    3.243700      -2.392900     -0.1022000    
 H    2.499000       1.874600     -5.5900000E-02
 H    6.130300       2.782000      0.7746000    
 H    6.367700       1.265100       1.672300    
 H    6.744700       1.351600     -8.5500002E-02


%chk=000019002-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019002

0 1
O -0.932129 -1.008061 -0.594693
O 4.929684 1.277600 0.702931
O 5.532620 -0.621149 -0.508075
N -4.425863 0.156221 0.020414
C -3.328616 -0.758898 -0.380562
C -4.792298 1.115736 -1.057922
C -5.596748 -0.539814 0.617187
C -1.975749 -0.124231 -0.032759
C -5.404231 2.424388 -0.523266
C -5.324797 -1.050566 2.044518
C 0.404564 -0.655509 -0.404214
C 1.356758 -1.539631 -0.978942
C 0.835977 0.496467 0.306217
C 3.172245 -0.121635 -0.135562
C 2.725869 -1.272205 -0.844535
C 2.214672 0.754003 0.435411
C 4.632813 0.112791 -0.024153
C 6.370856 1.574284 0.854250
H -3.419860 -1.715980 0.161686
H -3.349464 -1.002856 -1.467473
H -3.868995 1.362155 -1.615702
H -5.488301 0.646198 -1.798380
H -6.430590 0.184006 0.657446
H -5.942595 -1.385610 -0.029380
H -1.860357 -0.044046 1.065208
H -1.886722 0.887247 -0.477897
H -6.346196 2.246868 0.026441
H -4.698622 2.922031 0.164604
H -5.631077 3.112621 -1.358778
H -6.225901 -1.541577 2.456986
H -5.046689 -0.209008 2.702530
H -4.503012 -1.789430 2.069405
H 0.994941 -2.418804 -1.520143
H 0.114237 1.184473 0.754895
H 3.475018 -1.940776 -1.280798
H 2.561082 1.636481 0.980395
H 6.407138 2.502782 1.441629
H 6.879844 0.749742 1.381738
H 6.841292 1.710591 -0.134357


