%chk=000037621.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037621

0 1
 O  -0.3402000      -1.274700      0.1443000    
 O   0.4389000      0.8796000     -0.1916000    
 O   -6.234000       1.070600      0.6483000    
 N    1.916400     -0.9059000      0.1426000    
 C    3.190400     -0.2975000      7.5300001E-02
 C   -1.611300     -0.8017000      3.2400001E-02
 C   -4.218100      0.1652000     -0.1969000    
 C   -2.231400     -0.7567000      -1.216300    
 C   -2.294800     -0.3633000       1.166600    
 C   -3.534700     -0.2731000      -1.331000    
 C   -3.598200      0.1202000       1.051900    
 C    4.324800      -1.077700      0.2345000    
 C    3.280900       1.067200     -0.1490000    
 C    5.582300     -0.4777000      0.1678000    
 C    4.538400       1.667100     -0.2159000    
 C   0.6788000     -0.3053000      1.0400000E-02
 C    5.689000      0.8946000     -5.7399999E-02
 C   -5.577200      0.6692000     -0.3162000    
 H   -1.704700      -1.097400      -2.103700    
 H   -1.817800     -0.3964000       2.142500    
 H   -4.004200     -0.2445000      -2.311000    
 H   -4.111500      0.4563000       1.949100    
 H    4.253000      -2.147500      0.4103000    
 H    2.437600       1.729300     -0.2812000    
 H    1.912600      -1.909400      0.3088000    
 H    6.478300      -1.078900      0.2912000    
 H    4.623100       2.735700     -0.3912000    
 H    6.668100       1.361900     -0.1094000    
 H   -6.013900      0.6803000      -1.329300    


%chk=000037621-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000037621

0 1
O -0.317060 -0.514844 0.528225
O 0.690043 0.936382 -1.085084
O -6.807517 -0.512842 0.336050
N 1.915961 -0.391145 0.446481
C 3.272728 -0.081936 0.137911
C -1.681942 -0.289314 0.226274
C -4.465912 -0.052877 -0.135061
C -2.169977 0.564644 -0.793672
C -2.563742 -1.022539 1.062800
C -3.565994 0.669880 -0.959313
C -3.948492 -0.903723 0.881651
C 4.273824 -0.740715 0.900021
C 3.643905 0.837661 -0.877203
C 5.636451 -0.482940 0.649895
C 5.013612 1.083837 -1.113965
C 0.779877 0.110701 -0.150444
C 6.015834 0.432057 -0.359838
C -5.926175 0.084885 -0.340315
H -1.480025 1.122028 -1.427038
H -2.139834 -1.669603 1.836239
H -3.962039 1.326758 -1.743978
H -4.653696 -1.456879 1.511020
H 3.986762 -1.451867 1.685192
H 2.873043 1.342958 -1.462240
H 1.747961 -1.062892 1.198946
H 6.400007 -0.996826 1.243742
H 5.296304 1.794535 -1.898361
H 7.074465 0.632551 -0.554308
H -6.217772 0.781564 -1.167727


