%chk=000065973.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065973

0 1
 O    5.576200       2.441600      0.3226000    
 O   -6.207000      0.9348000      -1.548900    
 O    3.361600      -2.579600      5.8100000E-02
 O   -1.156500       1.709500      0.4743000    
 N    2.960100     -0.6296000      -1.132500    
 N   -2.953400      0.4413000       1.208800    
 N   -1.447700      -1.759200      0.9871000    
 C    5.192500      0.3418000     -0.7639000    
 C    4.285100     -0.4806000      -1.669400    
 C   -4.677700       1.799600      7.8900002E-02
 C   -3.884600       1.537200       1.352300    
 C    4.660200       1.747700     -0.5139000    
 C   -5.519900      0.6040000     -0.3493000    
 C    1.186100      -1.709400      0.1499000    
 C    2.601800      -1.683400     -0.2998000    
 C  -0.8264000     -0.6048000      0.6575000    
 C   -1.631600      0.5985000      0.7734000    
 C   0.4902000     -0.5263000      0.2326000    
 C   0.6113000      -2.916500      0.4711000    
 C  -0.7107000      -2.888100      0.8853000    
 C    5.123100       3.756500      0.6144000    
 C   -7.032800     -0.1348000      -1.988800    
 H    6.193600      0.4056000      -1.207700    
 H    5.324800     -0.1662000      0.2000000    
 H    4.187600      1.4000000E-03  -2.648100    
 H    4.723500      -1.471900      -1.828300    
 H   -3.998700       2.070900     -0.7395000    
 H   -5.331100       2.668200      0.2258000    
 H   -3.331100       2.439400       1.634400    
 H   -4.558300       1.284100       2.177700    
 H    4.553900       2.283900      -1.464100    
 H    3.682900       1.706900     -1.9400001E-02
 H   -4.885200     -0.2705000     -0.5318000    
 H   -6.245300      0.3573000      0.4349000    
 H    2.267800      4.1999999E-02  -1.445600    
 H   -3.286400     -0.4930000       1.429600    
 H   0.9379000      0.4366000      1.7800000E-02
 H    1.142700      -3.859000      0.4074000    
 H   -1.228800      -3.803000       1.153400    
 H    5.018700       4.339500     -0.3057000    
 H    5.865600       4.242500       1.253100    
 H    4.169700       3.723800       1.150600    
 H   -7.795400     -0.3647000      -1.238400    
 H   -6.430200      -1.023700      -2.198900    
 H   -7.532900      0.1733000      -2.910900    


%chk=000065973-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000065973

0 1
O 6.033625 2.464290 0.571637
O -6.905256 0.733513 -1.274995
O 3.349110 -2.783662 -0.317013
O -1.184927 1.873054 0.241834
N 3.216232 -0.573898 -1.044422
N -3.012260 0.526385 0.849182
N -1.546999 -1.724208 0.609288
C 5.490599 0.333736 -0.417506
C 4.640333 -0.482386 -1.418428
C -5.020442 1.706230 -0.124200
C -3.979597 1.618984 1.017177
C 5.096646 1.813255 -0.345163
C -5.937994 0.481274 -0.203864
C 1.206350 -1.660682 -0.125349
C 2.674016 -1.721219 -0.495985
C -0.903937 -0.543520 0.350919
C -1.708353 0.734794 0.472369
C 0.456959 -0.465543 -0.014166
C 0.549531 -2.885114 0.154493
C -0.816125 -2.871329 0.510968
C 5.738920 3.884385 0.754575
C -7.826682 -0.383852 -1.466457
H 6.551901 0.270221 -0.724120
H 5.414190 -0.115432 0.588857
H 4.713220 -0.043873 -2.433031
H 5.017764 -1.517898 -1.463662
H -4.502452 1.837877 -1.091107
H -5.647729 2.603424 0.037313
H -3.395490 2.554875 1.053115
H -4.493045 1.497739 1.991753
H 5.155734 2.286386 -1.354217
H 4.053815 1.933410 0.031452
H -5.354543 -0.441166 -0.429657
H -6.470884 0.325710 0.764037
H 2.615289 0.233441 -1.212359
H -3.270782 -0.456862 0.997670
H 0.863333 0.539592 -0.169853
H 1.118953 -3.816949 0.095545
H -1.349006 -3.802996 0.727449
H 5.808051 4.442837 -0.203839
H 6.495513 4.268917 1.456183
H 4.725949 4.038441 1.184463
H -8.424241 -0.583028 -0.550523
H -7.287868 -1.314135 -1.748643
H -8.502220 -0.091419 -2.285621


