%chk=000091509.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091509

0 1
 O   -1.366900     -0.8995000     -0.4730000    
 O  -0.4252000       1.235200     -0.3799000    
 O   -5.156100      0.6719000     -0.2152000    
 O   -2.890300       2.241000      0.6458000    
 O   -4.685900      -2.189400      0.3197000    
 O    5.308100     -0.6678000       1.322700    
 O    5.535500     -0.6664000     -0.8608000    
 N    4.846400     -0.4800000      0.1711000    
 C   -3.944800      0.1162000      0.2979000    
 C   -2.791500       1.033300     -0.1086000    
 C   -3.750300      -1.291000     -0.2656000    
 C   -1.434100      0.3795000      0.1547000    
 C   -2.346900      -1.798900      3.3300001E-02
 C   0.8692000      0.8141000     -0.2448000    
 C    1.396400      0.6000000       1.025100    
 C    1.649000      0.6024000      -1.377700    
 C    2.716200      0.1703000       1.163400    
 C    2.968800      0.1726000      -1.239200    
 C    3.502400     -4.3400001E-02  3.1399999E-02
 H   -4.055900      8.0600001E-02   1.388700    
 H   -2.887600       1.308700      -1.166500    
 H   -3.923900      -1.284100      -1.348600    
 H   -1.286300      0.2751000       1.237700    
 H   -2.192900      -1.955800       1.108500    
 H   -2.194100      -2.773700     -0.4430000    
 H   -5.242200       1.569300      0.1498000    
 H   -2.136900       2.802400      0.3946000    
 H   -5.575200      -1.834500      0.1495000    
 H   0.8054000      0.7786000       1.918500    
 H    1.236800      0.7689000      -2.369000    
 H    3.099800      1.6100001E-02   2.168900    
 H    3.551500      1.6400000E-02  -2.143600    


%chk=000091509-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091509

0 1
O -1.540683 -1.284051 -0.183872
O -0.402163 0.674323 -0.849631
O -5.225706 0.760922 -0.272069
O -2.764183 2.281371 -0.220908
O -5.030647 -1.836580 1.001561
O 5.419706 -0.841504 1.338302
O 5.935664 0.651301 -0.309791
N 5.086487 -0.029706 0.388478
C -3.957656 0.263533 0.263456
C -2.757087 0.841842 -0.497275
C -4.000208 -1.266805 0.138106
C -1.464426 0.167123 -0.004394
C -2.658397 -1.862886 0.599471
C 0.936248 0.436629 -0.488928
C 1.333986 -0.465173 0.530710
C 1.895041 1.167529 -1.233159
C 2.702238 -0.612146 0.820299
C 3.260966 1.015192 -0.950053
C 3.650533 0.129825 0.082172
H -3.861839 0.539519 1.337264
H -2.854125 0.637819 -1.583391
H -4.183258 -1.524075 -0.926255
H -1.258174 0.413665 1.063376
H -2.517476 -1.674273 1.684507
H -2.617835 -2.944630 0.408733
H -5.204851 1.751581 -0.242920
H -2.061080 2.714908 -0.767408
H -5.882858 -1.373139 0.793253
H 0.593328 -1.073974 1.053383
H 1.551808 1.843673 -2.021039
H 3.048733 -1.298910 1.596844
H 4.026414 1.565196 -1.503022


