%chk=000178492.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178492

0 1
 N  -0.1337000      -2.222100     -0.2335000    
 N  -0.2652000     -7.4000001E-02 -0.7855000    
 N   -2.202000      -1.470400      -1.061600    
 N    1.983200       1.768000     -0.5182000    
 N    4.394700      0.7497000      0.4814000    
 C    1.105200      -1.698400      3.1300001E-02
 C    1.000000     -0.3572000     -0.3203000    
 C  -0.9172000      -1.213100     -0.7195000    
 C    2.127000      0.4723000     -0.1643000    
 C    2.275300      -2.263100      0.5327000    
 C    3.377800      -1.409000      0.6757000    
 C    3.328100     -5.6800000E-02  0.3385000    
 C  -0.5250000      -3.600100     -3.0700000E-02
 C   -3.132400     -0.4881000      -1.587200    
 C    4.647200      -1.996000       1.213800    
 C    3.069100       2.545100     -0.3619000    
 C   -3.874500      0.2255000     -0.4887000    
 C    4.252300       2.045000      0.1286000    
 C    2.952000       3.979200     -0.7430000    
 C   -5.077700     -0.2912000     -2.8600000E-02
 C   -3.344800       1.390600      4.8400000E-02
 C   -5.765000      0.3702000      0.9894000    
 C   -4.032100       2.052100       1.066100    
 C   -5.242100       1.541800       1.537100    
 H    2.333600      -3.312100      0.8004000    
 H   -2.592000      -2.402000     -0.9427000    
 H  -0.8385000      -4.014400     -0.9926000    
 H   0.3087000      -4.185600      0.3593000    
 H   -1.349500      -3.621500      0.6870000    
 H   -3.850400     -0.9983000      -2.241600    
 H   -2.617200      0.2342000      -2.233800    
 H    4.933700      -1.494400       2.144200    
 H    4.545000      -3.063800       1.435700    
 H    5.455400      -1.889600      0.4824000    
 H    5.133700       2.662300      0.2578000    
 H   -5.492700      -1.204000     -0.4466000    
 H   -2.405600       1.800100     -0.3119000    
 H    3.150400       4.620800      0.1214000    
 H    3.663800       4.221400      -1.538500    
 H    1.945600       4.207700      -1.109100    
 H   -6.706800     -2.7400000E-02   1.356100    
 H   -3.625500       2.964800       1.491800    
 H   -5.777100       2.056800       2.329700    


%chk=000178492-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178492

0 1
N -0.104376 -2.365776 -0.148297
N -0.352628 -0.149875 -0.716774
N -2.276211 -1.612451 -0.963784
N 1.962609 1.836357 -0.546556
N 4.456464 0.775213 0.398071
C 1.148627 -1.755533 0.065346
C 0.971527 -0.391818 -0.309546
C -0.964804 -1.348906 -0.609478
C 2.083434 0.499568 -0.203468
C 2.372248 -2.288029 0.543572
C 3.485024 -1.441991 0.651513
C 3.345131 -0.050659 0.280822
C -0.433726 -3.780795 0.012179
C -3.125815 -0.534881 -1.528107
C 4.821064 -1.951178 1.150261
C 3.061039 2.615694 -0.420007
C -3.934855 0.227892 -0.481156
C 4.305909 2.067096 0.053611
C 2.944325 4.077658 -0.786781
C -5.331747 0.022231 -0.356760
C -3.291724 1.152514 0.384801
C -6.079012 0.719373 0.621517
C -4.037555 1.847617 1.361590
C -5.431829 1.632838 1.484446
H 2.462104 -3.341425 0.832307
H -2.762758 -2.366764 -0.476420
H -1.142288 -4.090804 -0.776626
H 0.479799 -4.387395 -0.099627
H -0.876647 -3.997452 1.003080
H -3.803657 -0.996246 -2.270395
H -2.441210 0.147442 -2.059147
H 5.148227 -1.395792 2.047336
H 4.769568 -3.026055 1.397088
H 5.611729 -1.798138 0.394043
H 5.189467 2.710073 0.148693
H -5.839324 -0.678893 -1.032602
H -2.212826 1.315080 0.276185
H 3.145185 4.727940 0.085702
H 3.670045 4.354783 -1.574357
H 1.926318 4.281718 -1.152763
H -7.159409 0.555171 0.706033
H -3.534189 2.562726 2.022151
H -6.008453 2.176870 2.241302


