%chk=000027926.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027926

0 1
 O  -0.8950000     -0.2979000      -1.922900    
 N    1.249600      -1.015500     -0.1186000    
 C    3.427400      0.1708000     -0.3976000    
 C    1.943600      0.2604000      2.0700000E-02
 C  -0.1498000     -0.9463000      0.3052000    
 C    4.083100       1.557000     -0.2114000    
 C    4.189200     -0.9729000      0.3109000    
 C  -0.8996000      0.1005000     -0.5491000    
 C  -0.7512000      -2.347400      0.1788000    
 C    5.527000       1.626500     -0.6876000    
 C    4.274700     -0.8541000       1.826300    
 C   -2.348800      0.2854000     -0.1529000    
 C   -3.318300     -0.4986000     -0.7535000    
 C   -2.672200       1.234000      0.8016000    
 C   -4.653700     -0.3285000     -0.3883000    
 C   -4.007700       1.404000       1.166700    
 C   -4.998300      0.6227000      0.5718000    
 H    3.451700     -5.8699999E-02  -1.472900    
 H    1.504700       1.028000     -0.6224000    
 H    1.871100      0.6148000       1.055900    
 H  -0.1910000     -0.6593000       1.363800    
 H    4.035200       1.867400      0.8388000    
 H    3.506500       2.299400     -0.7778000    
 H    5.206100      -1.040500     -9.3099996E-02
 H    3.720700      -1.933600      6.4300001E-02
 H    1.316700      -1.344500      -1.080700    
 H  -0.4506000       1.096700     -0.5039000    
 H   -1.755700      -2.392700      0.6103000    
 H  -0.8051000      -2.685400     -0.8616000    
 H  -0.1445000      -3.076500      0.7297000    
 H    5.884600       2.660600     -0.6478000    
 H    5.618200       1.276800      -1.720700    
 H    6.188800       1.027100     -5.6100000E-02
 H    3.283000     -0.8527000       2.287200    
 H    4.800700      5.5500001E-02   2.129400    
 H    4.827300      -1.706500       2.235000    
 H   2.2299999E-02 -0.2461000      -2.239600    
 H   -3.080400      -1.254800      -1.495400    
 H   -1.907300       1.844600       1.272300    
 H   -5.425000     -0.9386000     -0.8493000    
 H   -4.276200       2.143900       1.915100    
 H   -6.038000      0.7545000      0.8570000    


%chk=000027926-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000027926

0 1
O -0.658879 -0.269848 -1.784480
N 1.169589 -0.685917 0.077149
C 3.450928 0.272402 -0.423065
C 2.090832 0.457087 0.297023
C -0.216799 -0.530348 0.608128
C 4.309327 1.554594 -0.231919
C 4.193118 -1.027982 0.005306
C -1.009669 0.292086 -0.486499
C -0.824015 -1.923171 0.853367
C 5.634789 1.559788 -1.024012
C 4.580797 -1.109559 1.500220
C -2.515076 0.281259 -0.278295
C -3.364192 -0.455221 -1.138464
C -3.084689 1.009711 0.797289
C -4.759980 -0.476269 -0.916504
C -4.479148 0.984486 1.023253
C -5.322839 0.238294 0.166726
H 3.229434 0.174221 -1.507533
H 1.605898 1.366320 -0.106267
H 2.260843 0.644546 1.384494
H -0.228357 0.048399 1.559921
H 4.523123 1.703951 0.846102
H 3.701780 2.427706 -0.546830
H 5.107778 -1.127055 -0.610037
H 3.571967 -1.907314 -0.262336
H 1.587142 -1.575558 0.377953
H -0.655130 1.347453 -0.426196
H -1.837500 -1.840460 1.277953
H -0.897901 -2.486871 -0.094522
H -0.202263 -2.501483 1.563630
H 6.147679 2.534055 -0.925392
H 5.454494 1.381361 -2.100970
H 6.332623 0.781305 -0.665760
H 3.697525 -1.040757 2.162262
H 5.274495 -0.297867 1.785155
H 5.084710 -2.068621 1.719390
H 0.285393 -0.602287 -1.617931
H -2.910974 -0.987421 -1.979861
H -2.440316 1.606356 1.456391
H -5.409387 -1.045373 -1.591998
H -4.907835 1.550923 1.858147
H -6.405515 0.222580 0.336612


