%chk=000084647.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084647

0 1
 O    1.118800      0.8045000     -6.9999998E-04
 O   0.1529000       2.894100     -3.9999999E-04
 O   -5.940200     -0.4957000      1.2000001E-03
 O   -4.852200      -2.402400     -1.4000000E-03
 N   -4.867900      -1.147600      9.9999997E-05
 C    3.454800      0.3078000       0.000000    
 C    2.422300       1.396600       0.000000    
 C   -1.211900      0.9391000     -9.9999997E-05
 C    3.927700     -0.1924000       1.208200    
 C    3.929000     -0.1915000      -1.207900    
 C   -2.416300       1.642500      1.1000000E-03
 C   -1.218800     -0.4558000     -1.2000001E-03
 C   5.0999999E-02   1.660100     -7.9999998E-04
 C   -3.634700     -0.4439000      9.9999997E-05
 C   -3.627800      0.9510000      1.3000000E-03
 C   -2.430200      -1.147400     -1.1000000E-03
 C    4.887400      -1.204700       1.208400    
 C    4.888600      -1.203900      -1.207500    
 C    5.367700      -1.710500      6.0000003E-04
 H    2.538500       2.031400      0.8871000    
 H    2.539000       2.031900     -0.8867000    
 H   -2.432900       2.729300      1.9000000E-03
 H  -0.3057000      -1.044600     -2.3000001E-03
 H    3.558600      0.1926000       2.154800    
 H    3.561100      0.1941000      -2.154700    
 H   -4.546600       1.531900      2.3000001E-03
 H   -2.397700      -2.234000     -2.0999999E-03
 H    5.259900      -1.599600       2.149000    
 H    5.262300      -1.598400      -2.148000    
 H    6.114500      -2.499000      7.9999998E-04


%chk=000084647-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000084647

0 1
O 1.136786 0.754905 0.000055
O 0.151199 2.870067 0.000777
O -6.110925 -0.386183 0.000234
O -5.050794 -2.405540 -0.000635
N -5.046270 -1.115209 -0.000484
C 3.535872 0.340265 0.000303
C 2.491024 1.425211 0.000438
C -1.255227 0.874546 0.000009
C 4.034094 -0.177732 1.222527
C 4.034621 -0.176922 -1.222047
C -2.453405 1.634966 0.000376
C -1.307312 -0.543763 -0.000515
C 0.044266 1.618595 0.000181
C -3.728672 -0.423187 -0.000318
C -3.702614 0.989050 0.000218
C -2.551072 -1.202720 -0.000683
C 5.010362 -1.198396 1.224207
C 5.010891 -1.197585 -1.223982
C 5.500505 -1.710387 0.000049
H 2.539384 2.068638 0.896446
H 2.539651 2.069114 -0.895214
H -2.381181 2.726897 0.000776
H -0.373819 -1.112033 -0.000786
H 3.655668 0.219012 2.172407
H 3.656606 0.220450 -2.171827
H -4.643011 1.545621 0.000493
H -2.627346 -2.292865 -0.001085
H 5.390281 -1.590528 2.173887
H 5.391221 -1.589087 -2.173757
H 6.260417 -2.499701 -0.000048


