%chk=000043933.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043933

0 1
 O  -0.4761000      0.7206000      0.2324000    
 N  -0.7736000      -1.496200     -0.1344000    
 N    6.443700       1.430300     -0.5491000    
 C    3.096600     -0.1162000      0.3695000    
 C    4.463000      0.4565000      0.5616000    
 C   0.7529000      0.1255000      0.2315000    
 C   0.5670000      -1.230700      7.1000000E-03
 C    1.987400      0.7351000      0.4186000    
 C    2.953200      -1.491100      0.1454000    
 C    1.689300      -2.070000     -3.9200000E-02
 C    5.101800      0.8978000     -0.7603000    
 C   -1.333000     -0.3145000      7.1999999E-03
 C   -2.723700      4.3900002E-02 -3.8300000E-02
 C   -3.114200       1.373900      0.1419000    
 C   -3.694700     -0.9361000     -0.2621000    
 C   -4.464500       1.721000      9.8700002E-02
 C   -5.045100     -0.5892000     -0.3054000    
 C   -5.429900      0.7394000     -0.1249000    
 H    4.411700       1.307700       1.254000    
 H    5.103300     -0.2846000       1.058800    
 H    2.076300       1.801200      0.5892000    
 H    3.830300      -2.133900      0.1092000    
 H    1.589700      -3.136300     -0.2127000    
 H    4.486100       1.668200      -1.238200    
 H    5.158000      5.2000001E-02  -1.455400    
 H   -2.392900       2.167900      0.3186000    
 H   -3.419300      -1.978400     -0.4053000    
 H    6.861300       1.660700      -1.449700    
 H    7.035900      0.7117000     -0.1347000    
 H   -4.764700       2.755300      0.2391000    
 H   -5.797100      -1.353200     -0.4794000    
 H   -6.481400       1.009500     -0.1586000    


%chk=000043933-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043933

0 1
O -0.467939 0.823381 0.281105
N -0.810332 -1.436579 -0.137890
N 6.565139 1.369724 -0.592054
C 3.167830 -0.117952 0.408387
C 4.576246 0.430667 0.567237
C 0.792530 0.188759 0.267064
C 0.578544 -1.196257 0.010276
C 2.052563 0.758975 0.470151
C 2.965527 -1.510156 0.149752
C 1.685220 -2.068699 -0.050232
C 5.221863 0.799620 -0.797531
C -1.396400 -0.253754 0.022933
C -2.814306 0.086578 -0.029799
C -3.256848 1.424237 0.159638
C -3.764745 -0.942922 -0.276085
C -4.633325 1.724010 0.102048
C -5.137651 -0.634069 -0.331558
C -5.577607 0.699014 -0.143138
H 4.585365 1.340210 1.194447
H 5.220827 -0.317840 1.070323
H 2.180767 1.826560 0.672162
H 3.844093 -2.165428 0.116277
H 1.545816 -3.136437 -0.240617
H 4.593762 1.564663 -1.291363
H 5.200667 -0.103929 -1.454430
H -2.521476 2.212053 0.348866
H -3.406218 -1.967263 -0.419227
H 6.948551 1.870097 -1.398469
H 7.242403 0.718459 -0.183322
H -4.970925 2.755818 0.248123
H -5.866237 -1.429747 -0.521110
H -6.646403 0.936007 -0.186863


