%chk=000094614.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094614

0 1
 O    1.150200     -0.1587000     -0.6078000    
 O   -1.930600       2.466600     -3.0800000E-02
 O    2.884900      -1.401400     -5.9999999E-02
 O    3.261900      0.6595000     -0.8231000    
 N   -1.312100       1.578900     -0.6067000    
 N    2.556000     -0.2963000     -0.4931000    
 C   -1.811900     -0.8426000     -0.1110000    
 C   -1.004200      0.4391000      0.3333000    
 C   0.5379000      0.3630000      0.5807000    
 C   -3.308900     -0.4584000     -0.2658000    
 C   -1.358600      -1.437900      -1.462200    
 C   -1.752000      -1.959100      0.9495000    
 C   0.8784000     -0.6523000       1.691600    
 C    1.208900       1.699700      0.9054000    
 H   -1.436300      0.7425000       1.301000    
 H   -3.479000      0.2314000      -1.099400    
 H   -3.693800      5.7999999E-03  0.6494000    
 H   -3.926500      -1.342200     -0.4669000    
 H   -2.044300      -2.228500      -1.790200    
 H  -0.3669000      -1.894500      -1.393900    
 H   -1.333200     -0.6799000      -2.251700    
 H  -0.8421000      -2.556800      0.8822000    
 H   -2.569800      -2.676800      0.8051000    
 H   -1.859500      -1.562500       1.963900    
 H    1.880600     -0.4835000       2.106300    
 H   0.8697000      -1.690600       1.358900    
 H   0.1979000     -0.5389000       2.542600    
 H   0.6480000       2.225200       1.687100    
 H    2.230900       1.594800       1.286000    
 H    1.261500       2.354100      2.7899999E-02


%chk=000094614-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094614

0 1
O 1.108520 -0.596078 -0.305336
O -2.098988 2.297791 -0.449316
O 2.915568 -1.646143 -1.253682
O 3.331870 -0.343656 0.581159
N -1.143735 1.493746 -0.692430
N 2.599264 -0.874756 -0.310050
C -1.788161 -0.856126 -0.163175
C -0.983541 0.415306 0.381796
C 0.548406 0.347142 0.749833
C -3.300551 -0.562627 0.058670
C -1.539718 -1.104240 -1.679728
C -1.429017 -2.142321 0.627369
C 0.759010 -0.221658 2.169835
C 1.194650 1.747342 0.617451
H -1.503895 0.757016 1.302174
H -3.628467 0.369191 -0.434751
H -3.542862 -0.480298 1.134987
H -3.895883 -1.392875 -0.363195
H -2.099949 -2.006562 -1.988423
H -0.471744 -1.262601 -1.893718
H -1.890016 -0.259251 -2.298588
H -0.382905 -2.445683 0.459894
H -2.080579 -2.961691 0.269858
H -1.609824 -2.027230 1.712220
H 1.828552 -0.211531 2.431822
H 0.379147 -1.248509 2.268912
H 0.226519 0.417062 2.897140
H 0.619433 2.475313 1.218163
H 2.229504 1.736655 0.990590
H 1.186491 2.086972 -0.431185


