%chk=000004173.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004173

0 1
 O    3.230100       1.655400     -0.2213000    
 O   -2.659800       1.665500     -0.1573000    
 O  -0.6054000       2.234000      0.3674000    
 N   0.2076000     -0.4284000      0.2301000    
 N  -0.9747000      -2.246000     -0.2496000    
 N   -1.457300       1.346800      7.1699999E-02
 C    1.344100      0.3929000      0.5835000    
 C   0.2145000      -1.786100      6.9899999E-02
 C   -1.067200      4.9999999E-03 -2.0000001E-03
 C    2.107000      0.8894000     -0.6372000    
 C   -1.778400      -1.134500     -0.2962000    
 C    1.439400      -2.593900      0.2409000    
 H    1.073500       1.179900       1.289900    
 H    2.024900     -0.2261000       1.182300    
 H    2.474400      5.5700000E-02  -1.243700    
 H    1.481700       1.515200      -1.281900    
 H   -2.828200      -1.218000     -0.5397000    
 H    1.242700      -3.639700     -1.7800000E-02
 H    2.246400      -2.242200     -0.4084000    
 H    1.782500      -2.571200       1.279800    
 H    2.895400       2.406500      0.2978000    


%chk=000004173-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000004173

0 1
O 3.323599 1.705838 -0.220707
O -2.778334 1.569905 -0.185307
O -0.663380 2.301602 0.312223
N 0.244537 -0.436929 0.266542
N -1.008542 -2.264997 -0.275940
N -1.522807 1.354825 0.043279
C 1.435073 0.368016 0.621896
C 0.231219 -1.818074 0.089823
C -1.068747 0.002055 -0.013212
C 2.101323 1.007390 -0.621612
C -1.816307 -1.144708 -0.336169
C 1.419001 -2.704241 0.292790
H 1.135106 1.157622 1.327874
H 2.161523 -0.296248 1.118257
H 2.430376 0.228186 -1.329605
H 1.385482 1.682647 -1.128050
H -2.868008 -1.192286 -0.604647
H 1.129700 -3.727092 0.009134
H 2.282951 -2.398865 -0.324920
H 1.749812 -2.719914 1.348274
H 3.089623 2.585468 0.168277


