%chk=000050919.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050919

0 1
 O  -0.9471000      -1.884000      0.1759000    
 O    3.612600     -0.5931000      1.0700000E-02
 O   -2.145800       2.129700      9.6600004E-02
 O   -3.971500      0.1013000      7.9999998E-04
 N   -1.767000      0.7815000      4.0600002E-02
 C  -0.4045000      0.4756000      1.0000000E-03
 C  -3.4600001E-02 -0.8706000      5.9500001E-02
 C   -2.253500      -1.557600     -0.2612000    
 C   0.5845000       1.463200     -5.5000000E-02
 C    1.313900      -1.230700      7.2499998E-02
 C   -2.767800     -0.1452000     -3.5999998E-02
 C    2.296800     -0.2443000      5.7999999E-03
 C    1.932600       1.100000     -5.8600001E-02
 C    4.551400      0.4743000     -5.2499998E-02
 H   -2.940700      -2.241000      0.2499000    
 H   -2.320900      -1.768800      -1.335500    
 H    1.599400      -2.277900      0.1347000    
 H   0.3278000       2.518100     -9.7199999E-02
 H    2.642700       1.918500     -0.1083000    
 H   -2.471000       2.264400     -0.8100000    
 H    4.468700       1.032500     -0.9915000    
 H    5.550600      2.6200000E-02 -3.9299998E-02
 H    4.486000       1.124900      0.8263000    


%chk=000050919-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000050919

0 1
O -0.977523 -1.835139 0.296200
O 3.655408 -0.620194 0.098116
O -2.191736 2.167901 0.022987
O -4.013726 0.212150 -0.139708
N -1.786494 0.791453 -0.074372
C -0.396003 0.530017 -0.081148
C -0.005591 -0.830684 0.094875
C -2.289303 -1.578494 -0.340284
C 0.583202 1.531543 -0.202642
C 1.347429 -1.179445 0.148297
C -2.786739 -0.146214 -0.158457
C 2.332015 -0.164500 0.029935
C 1.953427 1.190221 -0.147486
C 4.720981 0.378127 -0.021134
H -2.996808 -2.266296 0.144721
H -2.228206 -1.814199 -1.423045
H 1.645413 -2.221246 0.287233
H 0.269846 2.571368 -0.322612
H 2.701801 1.981366 -0.237590
H -3.199942 2.073490 0.000324
H 4.678797 0.896983 -0.998525
H 5.657675 -0.192748 0.055687
H 4.668679 1.121543 0.797829


