%chk=000026936.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026936

0 1
 O  -0.6523000      -3.018500     -0.2824000    
 O   -3.019900      0.6892000       1.420900    
 O    5.472500      -1.007700      0.1522000    
 N  -0.1024000     -0.7296000      7.6700002E-02
 N  -0.8496000      0.4020000      0.4847000    
 C   -2.225300      -1.467400      0.6861000    
 C   -3.391900      -1.773700     -0.2352000    
 C  -0.9138000      -1.873800      5.6600001E-02
 C   -2.111200      1.3500000E-02  0.9609000    
 C   -3.244800      -1.034900      -1.567400    
 C   -3.516900      -3.279800     -0.4767000    
 C    1.323800     -0.8008000      9.5299996E-02
 C  -0.5688000       1.740700      7.3700003E-02
 C    1.980300      -1.875500     -0.5082000    
 C    2.067300      0.2037000      0.7188000    
 C   -1.243200       2.811100      0.6650000    
 C   0.3816000       1.984100     -0.9204000    
 C    3.373300      -1.945500     -0.4885000    
 C    3.460300      0.1340000      0.7386000    
 C  -0.9689000       4.118700      0.2641000    
 C   0.6559000       3.291700      -1.321100    
 C    4.113400     -0.9406000      0.1349000    
 C  -1.9300001E-02   4.359000     -0.7288000    
 H   -2.319300      -1.980700       1.650300    
 H   -4.318600      -1.430200      0.2428000    
 H   -2.343400      -1.330100      -2.114300    
 H   -4.100700      -1.259300      -2.214600    
 H   -3.226500      5.1300000E-02  -1.434900    
 H   -2.776100      -3.663000      -1.184100    
 H   -4.499300      -3.501500     -0.9099000    
 H   -3.440100      -3.843100      0.4591000    
 H    1.459000      -2.657000      -1.048200    
 H    1.611600       1.017200       1.273400    
 H   -1.952300       2.688000       1.475000    
 H   0.8745000       1.192400      -1.474100    
 H    3.877500      -2.779100     -0.9698000    
 H    4.025000      0.9141000       1.242100    
 H   -1.486300       4.951000      0.7323000    
 H    1.381800       3.478600      -2.107100    
 H   0.1931000       5.377000      -1.042100    
 H    5.820400     -0.2308000      0.6228000    


%chk=000026936-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026936

0 1
O -0.485621 -3.060036 -0.157436
O -3.065794 0.788245 1.291674
O 5.553690 -0.857825 0.196964
N -0.106065 -0.732964 0.040854
N -0.863967 0.415176 0.493136
C -2.275128 -1.493296 0.642898
C -3.483931 -1.821141 -0.302731
C -0.901428 -1.904327 0.114408
C -2.162643 0.010686 0.892652
C -3.269902 -1.254483 -1.725417
C -3.758587 -3.341421 -0.328288
C 1.332348 -0.720109 0.095445
C -0.516140 1.740272 0.054685
C 2.058367 -1.569744 -0.777880
C 2.021146 0.096897 1.023355
C -0.936395 2.846987 0.834637
C 0.206603 1.941538 -1.148436
C 3.463122 -1.606198 -0.715648
C 3.429367 0.074118 1.070964
C -0.635564 4.154586 0.397198
C 0.512825 3.255003 -1.561885
C 4.151144 -0.781050 0.203622
C 0.093481 4.366987 -0.795548
H -2.445244 -2.025429 1.599122
H -4.351496 -1.302733 0.152894
H -2.415264 -1.746587 -2.226280
H -4.168333 -1.436294 -2.341984
H -3.090428 -0.163472 -1.712560
H -2.881345 -3.896128 -0.704445
H -4.619664 -3.560779 -0.985912
H -3.995058 -3.724643 0.681995
H 1.523536 -2.211112 -1.481406
H 1.466158 0.748954 1.703270
H -1.504812 2.681271 1.752183
H 0.522900 1.086141 -1.751520
H 4.038926 -2.263192 -1.373280
H 3.957026 0.717863 1.786166
H -0.969711 5.008422 0.996478
H 1.075358 3.407072 -2.489465
H 0.331216 5.384341 -1.123984
H 5.945705 -0.256897 0.878004


