%chk=000085760.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085760

0 1
 O    3.051800       1.592800      0.7215000    
 N    2.028500     -6.1700001E-02 -0.5867000    
 C    1.050300     -0.8925000      0.1474000    
 C  -0.3384000     -0.3526000      7.6700002E-02
 C    1.156900      -2.314400     -0.4183000    
 C  -0.7557000      0.3534000      -1.051600    
 C   -1.219600     -0.5534000       1.139000    
 C   -2.054100      0.8588000      -1.117600    
 C   -2.518200     -4.8200000E-02   1.073100    
 C   -2.935400      0.6578000     -5.5300001E-02
 C    2.534000      0.7600000      7.1900003E-02
 H    1.346100     -0.9584000       1.207000    
 H   0.8930000      -2.340400      -1.482000    
 H   0.4864000      -3.001100      0.1097000    
 H    2.179800      -2.694800     -0.3217000    
 H  -9.5799997E-02  0.5125000      -1.900000    
 H  -0.9087000      -1.103300       2.023300    
 H   -2.380400       1.405600      -1.997400    
 H   -3.204800     -0.2052000       1.899900    
 H   -3.946700       1.050400     -0.1070000    


%chk=000085760-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085760

0 1
O 3.229020 2.031114 0.063352
N 2.105838 -0.125622 -0.091762
C 1.041400 -1.040653 0.319215
C -0.349299 -0.407930 0.183125
C 1.158640 -2.343682 -0.507656
C -0.716742 0.303153 -0.986332
C -1.299410 -0.570649 1.219548
C -2.015437 0.841199 -1.115764
C -2.602108 -0.036612 1.089698
C -2.963458 0.671222 -0.078997
C 2.614115 0.976288 0.042614
H 1.203724 -1.292988 1.387405
H 1.006613 -2.133195 -1.580072
H 0.389967 -3.064936 -0.181010
H 2.156634 -2.795999 -0.376120
H 0.017355 0.445714 -1.788257
H -1.021194 -1.111286 2.133300
H -2.288239 1.394607 -2.021254
H -3.328031 -0.165628 1.900219
H -3.970390 1.091185 -0.179352


