%chk=000028627.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028627

0 1
 O  -0.4037000      0.3614000     -1.3600000E-02
 O   0.5557000       2.389600      0.5013000    
 N   -5.125000     -0.6512000     -0.3929000    
 N    5.569800      -1.528500     -0.2357000    
 C   -4.156200      0.4057000     -0.1284000    
 C   -2.736000     -0.1428000     -0.2206000    
 C   -1.700900      0.9347000      7.2800003E-02
 C   -6.491700     -0.1399000     -0.2728000    
 C   -4.922300      -1.777000      0.5207000    
 C    1.934300      0.4857000      0.1023000    
 C   0.6402000       1.203200      0.2244000    
 C    3.048700       1.185800     -0.3128000    
 C    1.983200     -0.8589000      0.4088000    
 C    4.340000     -0.8473000     -0.1223000    
 C    4.264700      0.5120000     -0.4264000    
 C    3.199300      -1.532700      0.2952000    
 H   -4.274900       1.207400     -0.8680000    
 H   -4.316800      0.8507000      0.8626000    
 H   -2.548400     -0.9459000      0.5005000    
 H   -2.547600     -0.5708000      -1.213500    
 H   -1.853800       1.339000       1.080500    
 H   -1.789600       1.748100     -0.6571000    
 H   -6.654800      0.6890000     -0.9707000    
 H   -6.713800      0.2132000      0.7408000    
 H   -7.218600     -0.9165000     -0.5356000    
 H   -5.758800      -2.483200      0.4457000    
 H   -4.851700      -1.462500       1.568500    
 H   -4.040100      -2.367000      0.2534000    
 H    3.001900       2.243300     -0.5553000    
 H    1.112800      -1.412000      0.7490000    
 H    5.146500       1.057000     -0.7533000    
 H    3.245900      -2.591200      0.5381000    
 H    5.624300      -2.514500     -1.7400000E-02
 H    6.396800      -1.032600     -0.5404000    


%chk=000028627-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028627

0 1
O -0.393020 0.268450 -0.065363
O 0.541696 2.407052 -0.040200
N -5.243129 -0.694503 -0.206860
N 5.797589 -1.440099 -0.118582
C -4.201100 0.332026 0.032853
C -2.765545 -0.226827 -0.074147
C -1.736927 0.905202 -0.049907
C -6.579084 -0.085106 -0.372765
C -5.255827 -1.763222 0.812936
C 1.996642 0.449063 -0.075703
C 0.698075 1.156713 -0.058745
C 3.190581 1.221188 -0.073351
C 2.099098 -0.968936 -0.093435
C 4.552478 -0.820693 -0.104840
C 4.448910 0.604220 -0.087767
C 3.353290 -1.597214 -0.107520
H -4.335864 1.121202 -0.733453
H -4.331887 0.827614 1.033233
H -2.546890 -0.917889 0.760615
H -2.673945 -0.798962 -1.015146
H -1.821741 1.530787 0.859284
H -1.824286 1.570687 -0.929225
H -6.554084 0.647678 -1.199142
H -6.947161 0.441667 0.545475
H -7.314499 -0.867426 -0.632992
H -6.045103 -2.495106 0.565196
H -5.450428 -1.380500 1.848720
H -4.292365 -2.299665 0.820777
H 3.102562 2.312836 -0.060093
H 1.182820 -1.566092 -0.096449
H 5.360637 1.213820 -0.086043
H 3.418400 -2.692054 -0.120973
H 5.876594 -2.452997 -0.130958
H 6.652914 -0.891615 -0.117631


