%chk=000100006.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100006

0 1
 O   -1.958100       2.705000       1.426800    
 N  -0.2466000       1.545400      0.4429000    
 N    5.941800      0.1566000      6.4900003E-02
 C   -2.510900      0.5874000      0.4407000    
 C   -3.223900      0.9595000     -0.8591000    
 C   -1.836100     -0.7618000      0.3237000    
 C   0.2512000      0.4420000     -0.3831000    
 C  -0.4912000     -0.8487000     -8.4500000E-02
 C   -1.558400       1.704500      0.8296000    
 C    1.764100      0.3660000     -0.2642000    
 C   -4.267100     -9.5299996E-02  -1.218400    
 C   -3.870500       2.337100     -0.7397000    
 C   -2.568100      -1.932800      0.5737000    
 C   7.7799998E-02  -2.117400     -0.2769000    
 C   -1.977500      -3.183600      0.4101000    
 C  -0.6579000      -3.275600     -2.0400001E-02
 C    2.561000      0.6286000      -1.375800    
 C    2.347200      3.4100000E-02  0.9561000    
 C    3.949900      0.5585000      -1.266300    
 C    3.736000     -3.5799999E-02   1.065600    
 C    4.537400      0.2262000     -4.5699999E-02
 H   -3.235600      0.5247000       1.266000    
 H   -2.505900       1.009300      -1.688700    
 H  -1.0200000E-02  0.7148000      -1.414600    
 H   0.3903000       2.307900      0.6565000    
 H   -4.942700     -0.3037000     -0.3821000    
 H   -4.888300      0.2548000      -2.051600    
 H   -3.814300      -1.029000      -1.563300    
 H   -4.492700       2.416600      0.1584000    
 H   -4.516300       2.534400      -1.603200    
 H   -3.128300       3.141000     -0.7299000    
 H   -3.600700      -1.881300      0.9087000    
 H    1.097600      -2.227600     -0.6353000    
 H   -2.549300      -4.085200      0.6090000    
 H  -0.2008000      -4.250400     -0.1643000    
 H    2.117600      0.8885000      -2.333000    
 H    1.737400     -0.1695000       1.832300    
 H    4.563500      0.7652000      -2.139500    
 H    4.181800     -0.2948000       2.022500    
 H    6.368500     -8.6199999E-02  0.9491000    
 H    6.522900      0.3446000     -0.7411000    


%chk=000100006-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100006

0 1
O -1.932473 2.519770 1.819277
N -0.316175 1.515478 0.491646
N 5.954472 0.162238 0.017343
C -2.576714 0.541212 0.488002
C -3.214894 1.014904 -0.881079
C -1.882349 -0.809826 0.363573
C 0.190008 0.450145 -0.415907
C -0.540570 -0.867392 -0.102804
C -1.597573 1.604396 1.005568
C 1.709841 0.372652 -0.304523
C -4.256676 -0.006139 -1.393810
C -3.860435 2.414497 -0.746906
C -2.552933 -2.014718 0.684143
C 0.087692 -2.120474 -0.286795
C -1.920673 -3.265415 0.509100
C -0.598928 -3.318738 0.010884
C 2.535315 0.548092 -1.440186
C 2.336908 0.122377 0.944620
C 3.939741 0.477485 -1.346942
C 3.735930 0.054407 1.057764
C 4.565540 0.230498 -0.090942
H -3.398087 0.487837 1.226382
H -2.396694 1.076318 -1.629458
H -0.046941 0.725791 -1.468560
H 0.346291 2.241251 0.778201
H -5.089284 -0.109871 -0.670949
H -4.687372 0.339840 -2.351730
H -3.816929 -1.004956 -1.556974
H -4.669402 2.400770 0.007468
H -4.298693 2.723952 -1.714107
H -3.134079 3.182212 -0.432010
H -3.578294 -1.969652 1.069990
H 1.122315 -2.156009 -0.644283
H -2.453584 -4.189056 0.761249
H -0.101046 -4.284440 -0.130668
H 2.073963 0.745114 -2.416485
H 1.716107 -0.024745 1.836391
H 4.556421 0.617848 -2.243008
H 4.197481 -0.137334 2.034363
H 6.399156 -0.007685 0.914494
H 6.548216 0.291367 -0.796433


