%chk=000056651.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056651

1 1
 O    3.151900      -1.674600     -0.7975000    
 N   -3.312400      0.2749000     -0.3458000    
 N    2.074700     -8.9699998E-02  0.5698000    
 C   -3.650300      0.3186000       1.054700    
 C   -4.683500     -6.3000000E-03 -1.9000000E-03
 C   -2.496800     -0.8836000     -0.7866000    
 C   -3.031000       1.548100      -1.012000    
 C   -1.225600     -0.8917000     -6.7699999E-02
 C    2.106600       1.343300      0.7421000    
 C    3.457800       1.728100      0.1737000    
 C    3.712900      0.6814000     -0.9043000    
 C    1.092800     -0.9123000       1.242500    
 C    2.981700     -0.5358000     -0.3885000    
 C  -0.1788000     -0.9004000      0.5214000    
 H   -3.709500       1.285700       1.538500    
 H   -3.343600     -0.4922000       1.704400    
 H   -5.043800      -1.025800     -5.7700001E-02
 H   -5.431700      0.7452000     -0.2229000    
 H   -2.351800     -0.8023000      -1.869300    
 H   -3.046000      -1.812800     -0.5932000    
 H   -1.983700       1.813300     -0.8397000    
 H   -3.218400       1.429100      -2.083500    
 H   -3.676400       2.339800     -0.6160000    
 H    2.013200       1.611300       1.798300    
 H    1.283900       1.783100      0.1690000    
 H    4.225900       1.642400      0.9527000    
 H    3.482200       2.751700     -0.2104000    
 H    4.778900      0.4760000      -1.028100    
 H    3.272100      0.9770000      -1.861400    
 H    1.475800      -1.937800       1.285200    
 H   0.9768000     -0.5527000       2.269800    


%chk=000056651-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056651

1 1
O 0.484322 -0.910274 0.167852
N -3.362784 0.172017 -0.153838
N 1.935311 0.931076 0.409949
C -2.536431 -1.094196 0.121584
C -3.660246 -1.144625 -0.885666
C -2.673490 1.311897 -0.930072
C -4.316437 0.644524 0.906241
C -1.450959 1.733095 -0.251648
C 3.342082 1.318014 0.123449
C 4.040999 -0.050708 -0.119929
C 2.893019 -1.007215 -0.535639
C 0.959498 1.888334 0.967615
C 1.628814 -0.371874 0.049515
C -0.353016 1.837951 0.297247
H -2.703721 -1.515629 1.117538
H -1.479161 -1.038536 -0.173048
H -3.425124 -1.138811 -1.953405
H -4.613661 -1.608224 -0.616780
H -3.424129 2.114846 -1.039249
H -2.438116 0.924954 -1.937701
H -3.771373 1.308777 1.595422
H -5.148440 1.188849 0.431409
H -4.710271 -0.219395 1.463156
H 3.778902 1.865030 0.977600
H 3.384062 1.974534 -0.768010
H 4.506099 -0.403276 0.815989
H 4.831759 0.027679 -0.881889
H 3.013605 -2.034994 -0.158585
H 2.776246 -1.073043 -1.634120
H 0.810234 1.695912 2.050008
H 1.386308 2.904312 0.880604


