%chk=000037542.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037542

0 1
 O    1.392300     -0.5531000      -1.002300    
 O    1.888000       2.343400       1.067800    
 O    3.865300       1.093100     -0.3151000    
 O    1.867900      -3.221500     -0.2838000    
 O   -3.440600      -1.854000      0.5635000    
 N  -0.4685000      0.7913000     -0.4022000    
 N   -1.165900     -0.3029000     -6.1400000E-02
 N   -2.535000       1.500800     -0.3852000    
 N   -4.803700     -5.9599999E-02  0.2197000    
 C    3.042900      0.2641000      0.5061000    
 C    1.729200      0.9690000      0.7805000    
 C    2.598200     -0.9473000     -0.3074000    
 C   0.9865000      0.7451000     -0.5279000    
 C    2.279300      -2.158600      0.5578000    
 C   -1.289100       1.858800     -0.5931000    
 C   -2.410500      0.1792000     -6.5200001E-02
 C   -3.536400     -0.6477000      0.2482000    
 H    1.208500      0.4929000       1.619400    
 H    3.606300      2.6200000E-02   1.412800    
 H    3.327500      -1.222000      -1.077900    
 H    1.255500       1.485800      -1.291300    
 H    1.464900      -1.958400       1.261200    
 H    3.159200      -2.484400       1.120100    
 H    2.397600       2.745100      0.3436000    
 H    4.676900      0.5940000     -0.5101000    
 H  -0.9386000       2.842300     -0.8722000    
 H    1.088100      -2.918200     -0.7795000    
 H   -4.939000      0.9174000     -2.0099999E-02
 H   -5.633900     -0.5992000      0.4412000    


%chk=000037542-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037542

0 1
O 1.644896 -0.148322 -1.297708
O 2.122075 2.479013 1.138643
O 4.062166 1.050285 0.191764
O 1.427768 -3.014411 -0.820824
O -3.099607 -1.523076 1.746900
N -0.385926 0.879474 -0.514668
N -0.952058 -0.032944 0.377108
N -2.585747 1.050396 -0.864055
N -4.612369 -0.334592 0.407864
C 2.982496 0.175294 0.681890
C 1.754922 1.124408 0.796480
C 2.553983 -0.879058 -0.350801
C 1.074359 1.013799 -0.611169
C 1.816143 -2.092440 0.246153
C -1.376110 1.507681 -1.245691
C -2.282590 0.107487 0.128107
C -3.346461 -0.669085 0.848161
H 1.055550 0.767169 1.568577
H 3.254147 -0.271441 1.657503
H 3.391557 -1.235211 -0.976493
H 1.275685 1.914593 -1.216485
H 0.935148 -1.768295 0.835473
H 2.500822 -2.670671 0.891123
H 3.048362 2.614455 0.790718
H 4.925826 0.572841 0.173465
H -1.182890 2.258847 -2.006644
H 0.812046 -2.527808 -1.427126
H -4.722232 0.369813 -0.324139
H -5.419063 -0.796598 0.823077


