%chk=000040818.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040818

0 1
 O    1.721700      0.5813000     -1.6000000E-03
 O   -1.721700     -0.5813000     -1.6000000E-03
 O    2.976900      -1.241600      5.9000002E-03
 O   -2.976800       1.241600      6.0000001E-03
 O    3.989400      0.7448000     -1.0700000E-02
 O   -3.989500     -0.7448000     -1.0700000E-02
 N    3.014800     -1.0600000E-02 -2.4000001E-03
 N   -3.014800      1.0600000E-02 -2.4000001E-03
 C   0.6628000     -0.3684000      8.8000000E-03
 C  -0.6628000      0.3685000      8.7000001E-03
 H   0.7091000      -1.012600     -0.8791000    
 H   0.7151000      -1.001700      0.9040000    
 H  -0.7091000       1.012500     -0.8792000    
 H  -0.7151000       1.001800      0.9039000    


%chk=000040818-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000040818

0 1
O 1.717805 0.596477 0.002139
O -1.717807 -0.596462 0.002179
O 3.141148 -1.315119 0.003419
O -3.141148 1.315130 0.003385
O 4.024115 0.807681 -0.001627
O -4.024110 -0.807669 -0.001579
N 3.103484 -0.045394 0.001306
N -3.103483 0.045404 0.001328
C 0.636891 -0.428143 0.005846
C -0.636891 0.428157 0.005825
H 0.705950 -1.060084 -0.895472
H 0.709172 -1.056712 0.909215
H -0.705956 1.060054 -0.895524
H -0.709169 1.056779 0.909159


