%chk=000138550.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138550

0 1
 O   0.5569000       2.507600     -0.5285000    
 O    2.718900      8.2599998E-02  0.7232000    
 O   0.2051000      -2.152600      0.3467000    
 O   0.6106000      -1.258400      -1.625700    
 N   0.3946000      -1.201900     -0.4138000    
 C   0.3351000      0.1666000      0.1911000    
 C   -1.088300      0.2984000      0.7766000    
 C   0.6478000       1.150000     -0.9485000    
 C    1.414800      0.1918000       1.286500    
 C   -2.214600      6.5300003E-02 -0.2364000    
 C   -3.581000      0.1506000      0.4287000    
 H   -1.204700       1.295900       1.219500    
 H   -1.217100     -0.4062000       1.610300    
 H    1.660400       1.014900      -1.347100    
 H  -3.6400001E-02   1.048000      -1.799400    
 H    1.292700     -0.5988000       2.035600    
 H    1.376900       1.146900       1.822100    
 H   -2.170300      0.8163000      -1.032200    
 H   -2.134200     -0.9183000     -0.7099000    
 H   -4.372800     -6.3999998E-03 -0.3104000    
 H   -3.687000     -0.6120000       1.206900    
 H   -3.733800       1.133400      0.8863000    
 H  -0.3751000       2.691300     -0.3233000    
 H    2.815600     -0.8175000      0.3691000    


%chk=000138550-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000138550

0 1
O 0.295522 2.489752 -0.470762
O 2.772623 -0.004365 0.862840
O 1.192104 -2.209330 0.166776
O 0.000514 -1.518783 -1.640961
N 0.535040 -1.310055 -0.490423
C 0.366313 0.092797 0.152880
C -1.074462 0.173887 0.736081
C 0.639175 1.153363 -0.960172
C 1.403193 0.245284 1.296741
C -2.251384 0.178119 -0.266059
C -3.608255 0.265254 0.466538
H -1.101450 1.099788 1.344946
H -1.210217 -0.666320 1.445654
H 1.722662 1.183514 -1.157883
H 0.094222 0.891013 -1.883862
H 1.121644 -0.395296 2.155606
H 1.378281 1.304838 1.602701
H -2.164592 1.030874 -0.970716
H -2.220501 -0.733051 -0.890433
H -4.446678 0.273241 -0.252424
H -3.751532 -0.600667 1.139394
H -3.678942 1.182956 1.080394
H -0.673968 2.647335 -0.594166
H 2.874789 -0.986649 0.754708


