%chk=000066861.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066861

0 1
 O   0.6434000       1.863100     -0.5022000    
 O    6.492800     -0.2785000      0.4928000    
 O    5.417400       1.609300      0.8072000    
 O   -6.500300     -0.5892000      0.3615000    
 O   -5.051000      -2.229500      0.5298000    
 N  -0.5749000     -0.1027000     -0.1064000    
 N    5.435100      0.3964000      0.4860000    
 N   -5.320600      -1.016900      0.3524000    
 C    1.838900     -0.1208000     -0.2882000    
 C   -1.915300      0.3553000     -9.3300000E-02
 C   0.5988000      0.6386000     -0.3020000    
 C    3.031400      0.4974000      8.7899998E-02
 C   -2.938600     -0.5524000      0.1204000    
 C    1.835500      -1.468100     -0.6497000    
 C   -2.171500       1.700900     -0.2936000    
 C    4.220600     -0.2316000      0.1024000    
 C   -4.258200     -0.1004000      0.1342000    
 C    3.024500      -2.197100     -0.6351000    
 C    4.217000      -1.579000     -0.2589000    
 C   -3.490900       2.152800     -0.2797000    
 C   -4.534300       1.252200     -6.5800004E-02
 H  -0.4869000      -1.095700      9.1300003E-02
 H    3.017500       1.546900      0.3735000    
 H   -2.697600      -1.601500      0.2739000    
 H   0.9408000      -1.982900     -0.9867000    
 H   -1.422000       2.458700     -0.4652000    
 H    3.023600      -3.243900     -0.9250000    
 H    5.124100      -2.177800     -0.2612000    
 H   -3.707000       3.206000     -0.4353000    
 H   -5.549700       1.640200     -6.1500002E-02


%chk=000066861-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000066861

0 1
O 0.650416 1.902540 -0.371615
O 6.614928 -0.269078 0.420587
O 5.460178 1.665853 0.772857
O -6.598325 -0.630342 0.330674
O -5.037391 -2.284664 0.490477
N -0.594800 -0.069214 -0.089737
N 5.525684 0.421501 0.447851
N -5.379576 -1.049952 0.323638
C 1.852663 -0.197761 -0.256834
C -1.924470 0.433630 -0.092107
C 0.597189 0.642183 -0.252450
C 3.058330 0.461444 0.081486
C -2.967538 -0.503742 0.109251
C 1.887303 -1.570689 -0.619602
C -2.240073 1.809128 -0.285479
C 4.257334 -0.272019 0.078023
C -4.299153 -0.050222 0.111617
C 3.107558 -2.283498 -0.623178
C 4.309623 -1.640465 -0.265575
C -3.589690 2.222047 -0.277727
C -4.642073 1.304819 -0.079401
H -0.508831 -1.070032 0.100416
H 3.050035 1.525719 0.332659
H -2.774725 -1.570835 0.263086
H 0.978289 -2.090421 -0.945765
H -1.430293 2.525590 -0.431812
H 3.121237 -3.338093 -0.914674
H 5.269303 -2.163528 -0.256759
H -3.819077 3.281669 -0.427743
H -5.691457 1.608234 -0.068662


