%chk=000178048.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178048

0 1
 O    2.426700      0.3067000     -0.8912000    
 O   -4.248300     -0.4327000     -0.1405000    
 O    3.718200     -0.5899000      0.6653000    
 O    4.209100       1.456400     -7.1900003E-02
 N   -2.131600      0.4277000      0.2933000    
 N    3.552300      0.4135000     -2.9400000E-02
 N   -3.897000       1.835800     -0.1243000    
 C   -1.442600     -0.8298000      0.4744000    
 C  -0.3101000     -0.7000000       1.498700    
 C  -0.9357000      -1.373200     -0.8651000    
 C    1.387000     -0.5126000     -0.3674000    
 C   0.8936000      6.8200000E-02  0.9561000    
 C   0.2632000     -0.5913000      -1.397300    
 C   -3.484800      0.5211000     -6.9999998E-04
 H   -2.177200      -1.542200      0.8708000    
 H   2.0199999E-02  -1.705200       1.790800    
 H  -0.6757000     -0.2093000       2.408900    
 H   -1.736500      -1.364700      -1.614100    
 H  -0.6391000      -2.421600     -0.7329000    
 H    1.756500      -1.537000     -0.2203000    
 H   0.6323000       1.125400      0.8167000    
 H    1.665500      6.6799998E-02   1.732100    
 H   0.6367000      -1.060100      -2.316000    
 H  -4.5200001E-02  0.4209000      -1.689500    
 H   -1.590300       1.286500      0.3122000    
 H   -3.252800       2.610100     -4.1999999E-03
 H   -4.861700       2.065800     -0.3384000    


%chk=000178048-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178048

0 1
O 2.398219 0.458100 -0.857153
O -4.076244 -0.471469 -0.573816
O 3.911532 -0.613509 0.644478
O 4.615329 1.090888 -0.718686
N -2.167953 0.467757 0.392346
N 3.770542 0.289917 -0.240855
N -3.994519 1.833565 -0.216846
C -1.491421 -0.839617 0.530851
C -0.357649 -0.737903 1.578079
C -0.936335 -1.353338 -0.826166
C 1.352754 -0.448479 -0.267824
C 0.848616 0.102890 1.077859
C 0.247412 -0.495780 -1.337011
C -3.446282 0.550141 -0.156236
H -2.254931 -1.560241 0.878219
H -0.009941 -1.763969 1.806119
H -0.747166 -0.316545 2.523962
H -1.754725 -1.356527 -1.566417
H -0.611725 -2.405568 -0.695379
H 1.805969 -1.448917 -0.129102
H 0.565705 1.165324 0.936244
H 1.657182 0.078880 1.829550
H 0.652657 -0.910709 -2.276828
H -0.100269 0.532485 -1.551997
H -1.682672 1.306903 0.710148
H -3.534109 2.669518 0.135969
H -4.927277 1.911504 -0.613409


