%chk=000020464.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020464

0 1
 O  -0.3671000       1.383200     -2.2900000E-02
 O   -2.594600       1.189700      0.7826000    
 N    1.136300      -1.745200      0.1351000    
 N    1.263100     -0.3428000      0.1609000    
 N   -2.262000     -0.7671000     -0.4400000    
 C  -0.1991000      -2.037200     -0.1463000    
 C  -0.9386000     -0.9233000     -0.2152000    
 C  -1.2500000E-02  0.2163000      1.2900000E-02
 C    2.502200      0.3301000      1.7700000E-02
 C    1.882500      -2.527500       1.115800    
 C  -0.6697000      -3.445800     -0.2850000    
 C   -4.479300      0.1871000     -0.3555000    
 C   -3.024300      0.2850000      7.1400002E-02
 C   -5.327300       1.329900      0.1952000    
 C    2.603200       1.692100      0.3181000    
 C    3.633200     -0.3632000     -0.4241000    
 C    3.823100       2.354100      0.1780000    
 C    4.853100      0.2985000     -0.5641000    
 C   -6.770300       1.228800     -0.2715000    
 C    4.947900       1.657300     -0.2630000    
 H   -2.763900      -1.564500     -0.8218000    
 H    2.858400      -2.103600       1.364400    
 H    2.052300      -3.541000      0.7369000    
 H    1.318800      -2.600300       2.053200    
 H  -8.7099999E-02  -3.965400      -1.052700    
 H   -1.722700      -3.505300     -0.5757000    
 H  -0.5571000      -3.986700      0.6600000    
 H   -4.512800      0.1885000      -1.451500    
 H   -4.875600     -0.7742000     -7.0000002E-03
 H   -5.298900       1.321600       1.291300    
 H   -4.911600       2.292600     -0.1253000    
 H    1.759000       2.262900      0.6910000    
 H    3.593800      -1.411600     -0.7058000    
 H    3.898900       3.410700      0.4181000    
 H    5.727400     -0.2416000     -0.9156000    
 H   -7.359300       2.056500      0.1357000    
 H   -7.225700      0.2911000      6.2500000E-02
 H   -6.833400       1.272000      -1.363500    
 H    5.897600       2.172700     -0.3726000    


%chk=000020464-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000020464

0 1
O 0.061670 1.857357 -0.333015
O -3.593086 -1.580916 0.674570
N 1.104152 -1.398943 0.665951
N 1.403383 -0.051538 0.277592
N -2.174226 0.232565 0.242077
C -0.311895 -1.499230 0.803758
C -0.876736 -0.286907 0.424478
C 0.193017 0.662877 0.089770
C 2.680081 0.290879 -0.264589
C 1.982459 -1.961802 1.723061
C -0.893228 -2.783368 1.319351
C -4.604028 0.574463 0.087819
C -3.422352 -0.361219 0.360589
C -5.637952 -0.065179 -0.871895
C 3.110891 1.640607 -0.205578
C 3.496209 -0.696766 -0.874054
C 4.363576 1.990037 -0.751868
C 4.754651 -0.333489 -1.398698
C -6.906891 0.798958 -1.020826
C 5.195959 1.008714 -1.339689
H -2.134506 1.215390 -0.064868
H 3.034700 -1.876528 1.412835
H 1.737643 -3.027741 1.842845
H 1.846458 -1.440177 2.691274
H -0.464295 -3.652930 0.787903
H -1.983625 -2.763405 1.170392
H -0.696075 -2.915244 2.401375
H -5.101069 0.774465 1.058657
H -4.265064 1.551611 -0.307993
H -5.169804 -0.221632 -1.863407
H -5.894999 -1.066697 -0.481606
H 2.459390 2.395349 0.240892
H 3.127919 -1.723869 -0.964999
H 4.691496 3.034467 -0.711932
H 5.382185 -1.098283 -1.869533
H -7.630530 0.325562 -1.708986
H -6.668237 1.802394 -1.421448
H -7.410164 0.936931 -0.045016
H 6.170821 1.287637 -1.753489


