%chk=000023121.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023121

0 1
 O   0.4522000       1.738900     -2.5900001E-02
 O   -2.866000     -0.7879000      1.9600000E-02
 O    2.422000     -0.2743000      -1.129900    
 N  -0.5440000     -0.4190000     -4.4000000E-03
 N   -2.115800       1.354100      4.1999999E-03
 N    2.443700     -0.2054000       1.198500    
 C  -0.3010000      -1.864200      1.5000000E-03
 C   0.5141000      0.5153000     -1.9600000E-02
 C   -1.907200     -1.1100000E-02  6.0999999E-03
 C    1.902100     -4.6399999E-02 -5.0099999E-02
 H   0.2515000      -2.121400      0.9102000    
 H   0.3143000      -2.123000     -0.8654000    
 H   -1.223400      -2.448300     -3.1199999E-02
 H   -1.369600       2.038400     -6.2000002E-03
 H   -3.059400       1.727600      1.2400000E-02
 H    3.384500     -0.5659000       1.318400    
 H    1.933000      2.6200000E-02   2.044600    


%chk=000023121-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023121

0 1
O 0.428134 1.454915 0.744481
O -2.912011 -0.690858 -0.528201
O 2.165208 -1.655790 0.219958
N -0.600308 -0.526571 -0.010466
N -2.100083 1.360426 0.209124
N 2.820690 0.463237 0.940471
C -0.506255 -1.968987 -0.387951
C 0.487679 0.215507 0.412670
C -1.967456 0.042103 -0.130204
C 1.897162 -0.452535 0.503349
H -0.141724 -2.566475 0.459458
H 0.187060 -2.103745 -1.230364
H -1.521655 -2.279998 -0.672493
H -1.275151 1.893083 0.524177
H -3.033157 1.759384 0.128661
H 3.790667 0.174060 1.053323
H 2.512200 1.415845 1.146806


