%chk=000004977.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004977

0 1
 O   -3.648300     -0.7720000       1.176200    
 O  -0.3749000       2.244200     -0.4033000    
 O    3.884100      0.4652000      0.4387000    
 N   -1.297200     -0.5988000     -0.5288000    
 N    2.117900      -1.017400      0.1280000    
 N    1.767500       1.376800      2.0000000E-02
 N   7.1500003E-02  -2.334500     -0.2388000    
 C  -5.7399999E-02 -7.3899999E-02 -0.3013000    
 C   -2.524300      0.1200000     -0.7753000    
 C   0.7606000      -1.156800     -0.1275000    
 C   -3.292000      0.4378000      0.5110000    
 C   0.3748000       1.284800     -0.2429000    
 C   -1.168600      -1.963100     -0.4812000    
 C    2.682800      0.2797000      0.2134000    
 C   -4.582700       1.183600      0.2020000    
 C    2.956100      -2.196400      0.3069000    
 C    2.330200       2.720700      0.1029000    
 H   -3.132100     -0.5217000      -1.426400    
 H   -2.294700       1.024800      -1.345700    
 H   -2.667900       1.026600       1.192600    
 H   -2.006500      -2.630800     -0.6296000    
 H   -5.131400       1.401300       1.124700    
 H   -4.381100       2.128600     -0.3116000    
 H   -5.247700      0.5779000     -0.4237000    
 H    3.997200      -1.926000      0.5003000    
 H    2.912300      -2.804200     -0.6020000    
 H    2.578300      -2.775000       1.155500    
 H    1.584200       3.503500     -5.1199999E-02
 H    3.116200       2.817000     -0.6529000    
 H    2.787900       2.847100       1.089200    
 H   -4.103600     -0.5313000       2.001000    


%chk=000004977-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000004977

0 1
O -3.984506 -1.147670 0.641676
O -0.236378 2.393283 -0.544200
O 3.983982 0.478875 0.337633
N -1.324754 -0.541363 -0.446973
N 2.156634 -0.985579 0.172416
N 1.871895 1.398933 -0.100701
N 0.073823 -2.309111 -0.049646
C -0.033335 -0.009865 -0.277845
C -2.557622 0.234592 -0.693311
C 0.792735 -1.121001 -0.039232
C -3.498554 0.246031 0.522063
C 0.453404 1.343357 -0.329487
C -1.205468 -1.913045 -0.296895
C 2.746827 0.298959 0.149018
C -4.661148 1.231930 0.324824
C 2.995696 -2.173485 0.424986
C 2.523105 2.729173 -0.124077
H -3.097472 -0.205493 -1.550855
H -2.249020 1.263801 -0.939557
H -2.915546 0.520776 1.426776
H -2.065335 -2.573399 -0.351635
H -5.347216 1.209422 1.191615
H -4.286763 2.266525 0.220304
H -5.242648 0.972203 -0.577856
H 4.029935 -1.826770 0.562988
H 2.934905 -2.867180 -0.430049
H 2.643674 -2.698371 1.328683
H 1.738400 3.474187 -0.320185
H 3.292135 2.759193 -0.913094
H 3.013822 2.926446 0.842865
H -4.534008 -1.237653 1.459951


