%chk=000028255.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028255

0 1
 O    2.464000       1.334900      0.6700000    
 N   -2.602600      0.8988000      0.3445000    
 C    1.420600     -0.7764000      0.2145000    
 C   0.1100000     -0.1297000     -0.2446000    
 C    2.688500      7.9000004E-02  1.4900000E-02
 C   -1.088800      -1.036200      6.7800000E-02
 C   -2.438500     -0.4013000     -0.3071000    
 C    2.971900      0.3708000      -1.459900    
 C    3.917800     -0.5438000      0.6777000    
 C   -3.593400      -1.321500      8.6900003E-02
 C   -3.849600       1.525300     -6.4700000E-02
 H    1.550200      -1.739500     -0.2957000    
 H    1.320700      -1.001400       1.285200    
 H  -7.1999999E-03  0.8371000      0.2560000    
 H   0.1390000      6.1500002E-02  -1.322800    
 H  -0.9722000      -1.985300     -0.4706000    
 H   -1.085100      -1.279900       1.138700    
 H   -2.446300     -0.2678000      -1.396700    
 H    2.169200      0.9610000      -1.914000    
 H    3.098300     -0.5527000      -2.033700    
 H    3.882500      0.9716000      -1.568300    
 H    3.748600     -0.7033000       1.748800    
 H    4.786700      0.1195000      0.5975000    
 H    4.171300      -1.506600      0.2222000    
 H   -4.545400      -1.009700     -0.3542000    
 H   -3.715500      -1.379400       1.174600    
 H   -3.406400      -2.339800     -0.2737000    
 H   -2.588400      0.7915000       1.358100    
 H    2.286400       1.157100       1.609600    
 H   -3.964600       1.542900      -1.153600    
 H   -3.843300       2.568000      0.2706000    
 H   -4.727400       1.056700      0.3902000    


%chk=000028255-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028255

0 1
O 2.504017 1.435458 0.678303
N -2.681002 0.840814 0.422928
C 1.441579 -0.785012 0.294808
C 0.103848 -0.229513 -0.237876
C 2.686624 0.107195 0.023488
C -1.109892 -1.062165 0.227010
C -2.471393 -0.477409 -0.227495
C 2.866626 0.449279 -1.465296
C 3.958090 -0.562613 0.595213
C -3.623082 -1.492207 0.020155
C -3.748969 1.690431 -0.132298
H 1.628315 -1.791831 -0.133674
H 1.360103 -0.930647 1.395343
H -0.030871 0.816624 0.092292
H 0.120033 -0.214887 -1.346322
H -1.024017 -2.101510 -0.152539
H -1.110336 -1.136460 1.337125
H -2.412806 -0.278036 -1.318605
H 2.016958 1.049786 -1.829040
H 2.941386 -0.470658 -2.072861
H 3.786602 1.043051 -1.606079
H 3.830998 -0.805735 1.668549
H 4.820885 0.119086 0.494170
H 4.190724 -1.503475 0.062716
H -4.604989 -1.062654 -0.251959
H -3.659702 -1.783834 1.088181
H -3.480828 -2.412685 -0.577167
H -2.745758 0.744405 1.445881
H 2.370061 1.283333 1.649582
H -3.520224 1.918472 -1.190312
H -3.774958 2.651158 0.413233
H -4.777022 1.253637 -0.099253


