%chk=000041529.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041529

0 1
 O   0.4948000       2.552600      0.6733000    
 N   -1.672700     -0.4447000      0.2953000    
 C   -1.231400      0.9380000      7.3200002E-02
 C   7.9899997E-02   1.195200      0.8494000    
 C   -2.936400     -0.6899000     -0.3777000    
 C   -1.072400       1.146500      -1.434100    
 C    1.233500      0.3240000      0.3999000    
 C   -4.009600      0.2582000      0.1499000    
 C   -3.344600      -2.145900     -0.1765000    
 C    1.431500     -0.9020000       1.010600    
 C    2.064200      0.7726000     -0.6120000    
 C    2.494300      -1.704900      0.5965000    
 C    3.126900     -3.0500000E-02  -1.026100    
 C    3.341900      -1.269100     -0.4218000    
 H   -1.947300       1.673200      0.4564000    
 H  -8.1400000E-02   1.058800       1.926500    
 H   -2.855400     -0.5765000      -1.463500    
 H   -1.770200     -0.6129000       1.296500    
 H  -0.5109000       2.063600      -1.644700    
 H  -0.5462000      0.3195000      -1.924500    
 H   -2.035700       1.283000      -1.936800    
 H   -5.001200     -7.1400002E-02 -0.1826000    
 H   -4.032500      0.2820000       1.245500    
 H   -3.893200       1.280900     -0.2212000    
 H   -2.577900      -2.826300     -0.5643000    
 H   -4.279000      -2.364800     -0.7049000    
 H   -3.497900      -2.378100      0.8836000    
 H   0.7816000      -1.249100       1.808400    
 H    1.918700       1.727200      -1.108000    
 H  -0.2276000       3.122200      0.9883000    
 H    2.662400      -2.668900       1.067700    
 H    3.786000      0.3075000      -1.820500    
 H    4.169200      -1.894400     -0.7445000    


%chk=000041529-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000041529

0 1
O 0.499899 2.596914 0.735484
N -1.833793 -0.309883 0.450767
C -1.214812 0.958014 -0.001974
C 0.116040 1.177090 0.803428
C -3.093642 -0.764338 -0.200574
C -0.978917 0.982641 -1.522466
C 1.307917 0.359414 0.315680
C -4.276503 0.233612 -0.057096
C -3.460795 -2.147620 0.373854
C 1.306045 -1.052514 0.453515
C 2.427297 0.991872 -0.278650
C 2.403671 -1.817169 -0.000827
C 3.526188 0.225398 -0.730030
C 3.519847 -1.181583 -0.593873
H -1.859386 1.845318 0.254460
H -0.099501 0.906850 1.864543
H -2.872446 -0.889191 -1.277274
H -1.941088 -0.319750 1.477924
H -0.348109 1.851508 -1.780887
H -0.459340 0.065093 -1.847261
H -1.927345 1.072049 -2.081807
H -5.164204 -0.126662 -0.609710
H -4.561560 0.350544 1.006642
H -4.015642 1.231818 -0.455108
H -2.628121 -2.856985 0.226817
H -4.364164 -2.552965 -0.116313
H -3.670186 -2.080635 1.460274
H 0.431168 -1.546419 0.888168
H 2.429152 2.081365 -0.367014
H -0.286477 3.146354 0.982327
H 2.388407 -2.907768 0.109474
H 4.388183 0.728184 -1.183975
H 4.373617 -1.774953 -0.941217


