%chk=000060991.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060991

0 1
 O    4.113200      0.6574000      7.8000002E-02
 O   -4.053400      5.4000001E-03 -0.7262000    
 N    2.087500     -0.2044000     -9.5700003E-02
 N    2.901700      0.8587000      0.2110000    
 N   -3.453600      0.1998000      0.3415000    
 C   0.6852000     -0.1021000      1.4900000E-02
 C   5.7999998E-02   1.128100     -0.1820000    
 C  -7.4400000E-02  -1.231000      0.3217000    
 C   -1.329000       1.229200     -7.2700001E-02
 C   -1.461300      -1.129900      0.4310000    
 C   -2.088600      0.1002000      0.2338000    
 C    2.614800      -1.511600     -0.5553000    
 H   0.6194000       2.023900     -0.4345000    
 H   0.3763000      -2.202500      0.5025000    
 H   -1.801500       2.196000     -0.2322000    
 H   -2.037600      -2.019700      0.6752000    
 H    3.613800      -1.412600     -0.9947000    
 H    1.983100      -1.946400      -1.339000    
 H    2.690300      -2.208800      0.2861000    


%chk=000060991-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060991

0 1
O 4.032952 0.850165 -0.484721
O -4.164618 1.099475 0.185236
N 2.076324 -0.277383 -0.234230
N 2.770404 0.963022 -0.387490
N -3.593478 -0.054048 0.234722
C 0.664751 -0.183971 -0.121727
C 0.014003 1.091764 -0.172927
C -0.108069 -1.368883 0.043642
C -1.376243 1.167896 -0.060846
C -1.505501 -1.281075 0.156378
C -2.147110 -0.019446 0.105118
C 2.805052 -1.556127 -0.198097
H 0.614724 1.993703 -0.299993
H 0.373326 -2.348881 0.084360
H -1.897503 2.130729 -0.097447
H -2.123323 -2.176296 0.284671
H 3.875572 -1.317947 -0.308930
H 2.489298 -2.211034 -1.028481
H 2.643339 -2.071962 0.764161


