%chk=000076876.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076876

0 1
 O    3.323500       1.151300      1.0700000E-02
 N    1.976600       1.505600     -7.0799999E-02
 C    1.297800      -2.025300     -0.4078000    
 C  -0.1164000      -2.158500      0.1387000    
 C    2.013200     -0.8707000      0.2687000    
 C  -0.8753000     -0.8597000      4.9400002E-02
 C  -0.2233000      0.3874000      1.6700000E-02
 C    1.267300      0.4304000      5.0299998E-02
 C   -2.278600     -0.9015000      4.6100002E-02
 C  -0.9824000       1.564300     -3.7400000E-02
 C   -3.025300      0.2734000     -1.0700000E-02
 C   -2.377400       1.503400     -5.3800002E-02
 H    1.846200      -2.959400     -0.2414000    
 H    1.263000      -1.856500      -1.492100    
 H  -8.5600004E-02  -2.473200       1.189000    
 H  -0.6384000      -2.939100     -0.4277000    
 H    3.022600     -0.8944000     -0.1503000    
 H    2.097500      -1.039800       1.349000    
 H   -2.798300      -1.855900      8.6900003E-02
 H  -0.5007000       2.538100     -6.4199999E-02
 H   -4.110200      0.2286000     -1.7700000E-02
 H   -2.957800       2.420700     -9.5799997E-02
 H    3.759400       2.014300     -9.0200000E-02


%chk=000076876-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076876

0 1
O 3.336786 1.400241 0.197161
N 1.873715 1.542286 0.127019
C 1.238619 -2.134029 -0.457852
C -0.135030 -2.212074 0.240070
C 2.063838 -0.958119 0.103743
C -0.896573 -0.900280 0.105637
C -0.192818 0.340511 0.023084
C 1.294003 0.352345 0.079845
C -2.312189 -0.890978 0.062554
C -0.929236 1.554204 -0.096407
C -3.034508 0.315225 -0.051129
C -2.334993 1.544902 -0.130983
H 1.797405 -3.077872 -0.316029
H 1.091174 -1.998796 -1.546826
H 0.021976 -2.442927 1.315360
H -0.739382 -3.040773 -0.173208
H 3.011637 -0.825334 -0.447029
H 2.354513 -1.168899 1.154477
H -2.850629 -1.845246 0.117297
H -0.375941 2.495902 -0.159005
H -4.129687 0.299389 -0.084038
H -2.886596 2.487062 -0.223229
H 3.631317 2.346761 0.205088


