%chk=000035029.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035029

0 1
 O   7.5800002E-02  -2.272300     -0.1767000    
 O   -1.362500       2.109400      0.1889000    
 N    3.198800       1.177400      3.8300000E-02
 N   0.9111000       1.686500      0.1160000    
 N    1.657100     -0.5863000     -7.3700003E-02
 N  -0.6906000     -9.6699998E-02  3.7000000E-03
 C    4.309000      0.2814000     -4.9899999E-02
 C    1.857200      0.7378000      2.6200000E-02
 C    5.610700       1.059400     -3.3199999E-02
 C   0.3582000     -0.9343000     -7.9300001E-02
 C  -0.3387000       1.195700      9.8399997E-02
 C   -1.296500      -2.639400     -0.1826000    
 C   -2.683300       1.587300      0.1700000    
 C   -1.396600      -4.119000     -0.3517000    
 C   -3.647300       2.715000      0.3344000    
 C   -1.976800      -4.934800      0.5354000    
 C   -4.585600       3.032700     -0.5644000    
 H    4.302000     -0.4200000      0.7925000    
 H    4.257100     -0.3028000     -0.9759000    
 H    3.346100       2.177300      0.1158000    
 H    5.663100       1.757500     -0.8756000    
 H    5.710300       1.640900      0.8896000    
 H    6.464200      0.3778000     -0.1010000    
 H   -1.812100      -2.163800      -1.026400    
 H   -1.773300      -2.322000      0.7533000    
 H   -2.863700       1.056900     -0.7735000    
 H   -2.828100      0.8914000       1.005900    
 H  -0.9735000      -4.548800      -1.255700    
 H   -3.577100       3.304500       1.244800    
 H   -2.019300      -6.003000      0.3529000    
 H   -2.416000      -4.557200       1.452200    
 H   -5.258600       3.864000     -0.3848000    
 H   -4.699700       2.475900      -1.487800    


%chk=000035029-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035029

0 1
O 0.116384 -2.318005 -0.069331
O -1.340051 2.167452 0.075608
N 3.187560 1.171062 0.011946
N 0.914598 1.707820 0.047901
N 1.673108 -0.626088 -0.033323
N -0.702473 -0.105831 0.004400
C 4.357106 0.275711 -0.023246
C 1.896078 0.733401 0.008049
C 5.655617 1.098785 -0.029578
C 0.361044 -0.965049 -0.030910
C -0.344531 1.218393 0.040926
C -1.316973 -2.750172 -0.090485
C -2.752422 1.671179 0.091054
C -1.310663 -4.237061 -0.312684
C -3.626536 2.878315 0.288033
C -2.008236 -5.116994 0.446328
C -4.704884 3.163399 -0.482057
H 4.325907 -0.402425 0.850418
H 4.295730 -0.369478 -0.919623
H 3.315473 2.184016 0.043872
H 5.710722 1.756823 -0.916532
H 5.739628 1.725683 0.877565
H 6.528929 0.424830 -0.054996
H -1.825027 -2.208265 -0.911067
H -1.798269 -2.467295 0.862439
H -2.966675 1.144756 -0.855866
H -2.850667 0.946253 0.921780
H -0.717285 -4.585731 -1.168554
H -3.358752 3.524461 1.134757
H -2.012502 -6.188653 0.220410
H -2.595564 -4.792520 1.314437
H -5.342604 4.029162 -0.273969
H -4.982371 2.540464 -1.341603


