%chk=000130919.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130919

0 1
 O   -1.107800      -2.028600     -0.2720000    
 O    3.637500       1.703000      -1.959100    
 N  -0.8893000      0.2742000      0.1827000    
 N    1.934600       1.897900     -0.4301000    
 N    1.165300     -0.8815000      4.9899999E-02
 N   -2.897300       1.585000      0.2243000    
 C    1.252900       1.459300      0.7781000    
 C   0.3573000       2.520700       1.377000    
 C  -0.8353000       2.750500      0.4854000    
 C   0.5144000      0.2100000      0.3260000    
 C   -1.608700       1.469500      0.3035000    
 C   -1.599300     -0.9169000     -8.6300001E-02
 C   -3.072100     -0.8121000     -0.1512000    
 C    3.026400       1.259500     -0.9898000    
 C   -3.661100      0.4377000      1.4800000E-02
 C    2.567500     -0.9690000      0.1404000    
 C    3.469700     -1.2100000E-02 -0.3659000    
 C   -3.862800      -1.947400     -0.3702000    
 C   -5.055600      0.5472000     -3.9600000E-02
 C    3.092000      -2.141200      0.7066000    
 C    4.853200     -0.2369000     -0.3013000    
 C   -5.251100      -1.827400     -0.4221000    
 C   -5.848000     -0.5804000     -0.2565000    
 C    4.469000      -2.356000      0.7803000    
 C    5.348700      -1.404800      0.2749000    
 H    2.009800       1.193200       1.525200    
 H   0.9078000       3.458100       1.516200    
 H   1.4100000E-02   2.190500       2.365800    
 H  -0.5438000       3.117500     -0.5047000    
 H   -1.489200       3.509400      0.9305000    
 H    1.637100       2.766400     -0.8642000    
 H   -3.418600      -2.930400     -0.5004000    
 H   -5.533800       1.515700      8.6000003E-02
 H    2.420500      -2.905600       1.092800    
 H    5.558600      0.4957000     -0.6860000    
 H   -5.866400      -2.706300     -0.5911000    
 H   -6.929100     -0.4850000     -0.2970000    
 H    4.852400      -3.269500       1.225500    
 H    6.420400      -1.572200      0.3281000    


%chk=000130919-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000130919

0 1
O -1.097550 -1.985165 0.976675
O 4.101004 2.226064 -1.273640
N -0.924152 0.311561 0.336377
N 2.134590 2.121726 -0.077294
N 1.154626 -0.718108 -0.046050
N -2.938428 1.590865 -0.095601
C 1.224571 1.573826 0.951364
C 0.215021 2.664479 1.358180
C -0.844752 2.806276 0.243863
C 0.520925 0.326715 0.380756
C -1.642090 1.525899 0.131113
C -1.651457 -0.953673 0.524663
C -3.080932 -0.868809 0.162068
C 3.293189 1.532781 -0.577015
C -3.676402 0.391715 -0.152433
C 2.557224 -0.903197 0.001108
C 3.561893 0.091273 -0.246302
C -3.867873 -2.050058 0.146623
C -5.054134 0.450336 -0.490964
C 2.958653 -2.252261 0.223190
C 4.925364 -0.305801 -0.287036
C -5.228870 -1.981964 -0.196645
C -5.820290 -0.727997 -0.517762
C 4.317119 -2.611534 0.236720
C 5.309685 -1.633967 -0.029352
H 1.816728 1.237907 1.828521
H 0.742377 3.619033 1.536562
H -0.276512 2.381824 2.306277
H -0.357418 3.037656 -0.724400
H -1.563939 3.614425 0.446536
H 2.020318 3.104347 -0.344736
H -3.385466 -2.998691 0.403001
H -5.488105 1.427497 -0.722344
H 2.165685 -2.990163 0.375968
H 5.665538 0.460769 -0.537692
H -5.835825 -2.893041 -0.216167
H -6.882168 -0.680282 -0.782716
H 4.603406 -3.651746 0.425860
H 6.368346 -1.912817 -0.050776


