%chk=000017271.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017271

0 1
 O    4.664100     -0.2562000      0.8264000    
 N    4.116200     -0.1609000     -0.2816000    
 C  -0.5950000      -1.809000     -7.9700001E-02
 C   0.5357000     -0.8022000     -0.1168000    
 C   -1.809100     -0.9069000     -3.5999999E-03
 C   2.6900001E-02  0.5152000     -6.7699999E-02
 C   -1.417100      0.4507000      2.0000001E-03
 C    1.895400      -1.050000     -0.1879000    
 C   0.8849000       1.602000     -8.9699998E-02
 C   -3.141800      -1.274900      5.5199999E-02
 C   -2.366500       1.456800      6.7299999E-02
 C    2.760000      4.5800000E-02 -0.2103000    
 C    2.259900       1.358500     -0.1617000    
 C   -4.098600     -0.2606000      0.1210000    
 C   -3.714900       1.091700      0.1271000    
 H  -0.5239000      -2.438900      0.8117000    
 H  -0.6126000      -2.405800     -0.9962000    
 H    2.265300      -2.070400     -0.2250000    
 H   0.5138000       2.620700     -5.2800000E-02
 H   -3.439300      -2.317600      5.0600000E-02
 H   -2.085900       2.504700      7.2800003E-02
 H    2.939100       2.209200     -0.1798000    
 H   -5.153600     -0.5175000      0.1682000    
 H   -4.478500       1.863500      0.1790000    


%chk=000017271-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000017271

0 1
O 5.014526 0.605450 -0.067057
N 4.196642 -0.392082 -0.093398
C -0.650990 -1.865190 -0.068704
C 0.518329 -0.889488 -0.052735
C -1.862586 -0.943181 -0.017922
C 0.030156 0.456698 0.001666
C -1.438357 0.422368 0.023643
C 1.894387 -1.139266 -0.082745
C 0.928472 1.557034 0.026798
C -3.231225 -1.262578 -0.007450
C -2.385535 1.471823 0.075498
C 2.789273 -0.031817 -0.057969
C 2.309262 1.310702 -0.001986
C -4.179377 -0.210260 0.044348
C -3.759267 1.144474 0.085396
H -0.621340 -2.557256 0.795575
H -0.648654 -2.498093 -0.977623
H 2.318164 -2.148537 -0.126618
H 0.548745 2.583789 0.066554
H -3.566682 -2.305274 -0.038702
H -2.065958 2.519302 0.107549
H 3.045977 2.121386 0.016493
H -5.249817 -0.443614 0.052846
H -4.509646 1.941511 0.125042


