%chk=000020146.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020146

0 1
 O   -4.635200      -1.815600      -1.080500    
 N  -0.7202000      0.2526000      4.3000001E-03
 N    2.126900      5.1399998E-02 -0.1074000    
 C   -2.891600     -0.8897000      0.3360000    
 C   -2.088000      0.1292000     -0.4984000    
 C   -4.969900      0.3200000      2.4900001E-02
 C   -3.319600     -0.3779000       1.719900    
 C   -2.772700       1.517100     -0.5411000    
 C   -4.633100      0.4026000       1.518200    
 C   -4.290600       1.422800     -0.8007000    
 C   -4.241500     -0.9455000     -0.3215000    
 C  -6.6799998E-02  -1.061500      4.6599999E-02
 C   5.7200000E-02   1.170000     -0.8375000    
 C    1.346000     -0.9536000      0.6250000    
 C    1.474900       1.351800     -0.2897000    
 C    3.522600     -2.1600001E-02 -3.7599999E-02
 C    4.213100      -1.165300     -0.4861000    
 C    4.279900       1.046600      0.4838000    
 C    5.604300      -1.238200     -0.4159000    
 C    5.671100      0.9737000      0.5538000    
 C    6.333200     -0.1688000      0.1040000    
 H   -2.497500      -1.906800      0.3690000    
 H   -2.061700     -0.2440000      -1.534400    
 H   -6.043100      0.2485000     -0.1644000    
 H   -2.550500      0.2367000       2.198900    
 H   -3.507300      -1.227600       2.388300    
 H   -2.359600       2.142600      -1.340400    
 H   -2.606600       2.055600      0.4011000    
 H   -5.426100     -7.4199997E-02   2.107600    
 H   -4.551500       1.436500       1.870000    
 H   -4.753900       2.392100     -0.5834000    
 H   -4.451900       1.222000      -1.867900    
 H  -2.5699999E-02  -1.514000     -0.9530000    
 H  -0.5779000      -1.760100      0.7130000    
 H  -0.3724000       2.175600     -0.8582000    
 H   0.1060000      0.8057000      -1.872500    
 H    1.813400      -1.943900      0.5734000    
 H    1.301200     -0.6718000       1.685100    
 H    1.435200       1.885900      0.6685000    
 H    2.038300       1.970400     -0.9996000    
 H    3.666800      -2.006500     -0.9068000    
 H    3.798200       1.947400      0.8557000    
 H    6.120300      -2.126400     -0.7685000    
 H    6.239200       1.805000      0.9611000    
 H    7.416400     -0.2254000      0.1586000    


%chk=000020146-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000020146

0 1
O -4.920859 -1.884206 -0.925311
N -0.752144 0.101641 -0.125166
N 2.166316 -0.002174 -0.163647
C -3.010922 -0.897838 0.356724
C -2.173787 0.045673 -0.592000
C -5.055721 0.375504 0.148684
C -3.247023 -0.254097 1.750216
C -2.834631 1.451449 -0.626609
C -4.591790 0.564329 1.621555
C -4.374975 1.404278 -0.814707
C -4.422999 -0.962381 -0.235937
C -0.025139 -1.172285 -0.370031
C 0.056268 1.208362 -0.699065
C 1.356611 -1.151077 0.301541
C 1.447045 1.278290 -0.041427
C 3.576683 -0.026283 -0.004882
C 4.315290 -1.233954 -0.203545
C 4.316549 1.153056 0.316539
C 5.718716 -1.253663 -0.091306
C 5.724226 1.122042 0.416696
C 6.442637 -0.077065 0.216949
H -2.558183 -1.900420 0.400274
H -2.225597 -0.393036 -1.622953
H -6.149181 0.384018 0.011451
H -2.385677 0.377680 2.028187
H -3.343511 -1.037650 2.522241
H -2.402796 2.058488 -1.443223
H -2.596728 1.972597 0.320974
H -5.355746 0.168133 2.313868
H -4.449974 1.632511 1.867046
H -4.794394 2.411450 -0.629131
H -4.627113 1.135215 -1.859247
H 0.100483 -1.356236 -1.467009
H -0.597650 -2.015552 0.051089
H -0.445593 2.171907 -0.516224
H 0.187157 1.087551 -1.804813
H 1.873972 -2.095149 0.071335
H 1.215851 -1.100635 1.405938
H 1.326768 1.577084 1.026778
H 2.022889 2.066682 -0.556916
H 3.798076 -2.159112 -0.476192
H 3.799931 2.096688 0.513486
H 6.252408 -2.196789 -0.258186
H 6.259438 2.045755 0.667045
H 7.534122 -0.097381 0.300212


