%chk=000005020.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005020

0 1
 O   -1.241200       4.205700     -0.3333000    
 O    2.677900       1.858400      0.6047000    
 O    4.911300      0.3715000      0.4213000    
 N   -2.536200      -2.082400     -0.1006000    
 C   -1.223300      -1.460400      0.2129000    
 C   -1.226300      6.1999999E-02  3.7900001E-02
 C  -9.1899998E-02  -2.058400     -0.6540000    
 C   -2.443500      0.7711000      4.3400001E-02
 C   -3.606800      -1.386200      0.6307000    
 C   -3.755800      4.0899999E-02  0.1116000    
 C   7.7000000E-03  0.7537000     -6.4900003E-02
 C    1.235700      -1.394800     -0.3634000    
 C    1.274400     -1.3400000E-02 -7.5000003E-02
 C   -2.571900      -3.507800      0.2429000    
 C   -2.439700       2.163300     -8.3300002E-02
 C  -2.8800000E-02   2.154400     -0.1881000    
 C   -1.237700       2.851000     -0.1952000    
 C    2.418500      -2.147900     -0.4236000    
 C    2.528700      0.5636000      0.1929000    
 C    3.701600     -0.1957000      0.1483000    
 C    3.647300      -1.548700     -0.1654000    
 H  -0.9891000      -1.640800       1.273600    
 H  -0.3115000      -1.936200      -1.723000    
 H   9.3999999E-03  -3.130900     -0.4560000    
 H   -3.403100      -1.381900       1.710300    
 H   -4.568300      -1.894800      0.4864000    
 H   -4.450700      0.5823000      0.7647000    
 H   -4.190500      2.2700001E-02 -0.8960000    
 H   -2.310800      -3.687200       1.292000    
 H   -1.898700      -4.090100     -0.3928000    
 H   -3.571200      -3.922400      6.4700000E-02
 H   -3.382400       2.705300     -0.1010000    
 H   0.8657000       2.747000     -0.3451000    
 H    2.385100      -3.206900     -0.6663000    
 H    4.555800      -2.143100     -0.2051000    
 H   -2.160800       4.522400     -0.3221000    
 H    3.443800       1.926600       1.198700    
 H    4.864200       1.325800      0.2454000    


%chk=000005020-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005020

0 1
O -1.100082 4.254430 -0.488603
O 2.772088 1.769568 0.836099
O 4.962497 0.264398 0.593522
N -2.501613 -2.086006 0.014920
C -1.159062 -1.471215 0.194571
C -1.203054 0.055683 0.065332
C -0.125839 -2.000333 -0.834707
C -2.417720 0.780159 0.061901
C -3.534731 -1.359230 0.794425
C -3.739239 0.044735 0.206888
C 0.039033 0.749023 -0.095092
C 1.240214 -1.408217 -0.529713
C 1.297647 -0.041066 -0.111441
C -2.509431 -3.531837 0.326397
C -2.405716 2.188921 -0.091742
C 0.035707 2.154981 -0.294086
C -1.183949 2.864656 -0.284101
C 2.425044 -2.167336 -0.617447
C 2.552687 0.483212 0.286555
C 3.740970 -0.288637 0.193722
C 3.680950 -1.611411 -0.277495
H -0.761135 -1.719089 1.218943
H -0.481022 -1.719736 -1.846864
H -0.061086 -3.101135 -0.800169
H -3.257488 -1.282417 1.877944
H -4.478626 -1.931059 0.736490
H -4.434766 0.625850 0.843031
H -4.212315 -0.056260 -0.789495
H -2.175320 -3.756798 1.371132
H -1.856625 -4.085916 -0.367858
H -3.534095 -3.922967 0.200796
H -3.354862 2.742127 -0.082258
H 0.939977 2.703232 -0.578175
H 2.371859 -3.210678 -0.947485
H 4.605406 -2.192140 -0.341565
H -2.001020 4.661861 -0.515674
H 1.917977 2.209909 1.079417
H 4.793640 1.188439 0.920088


