%chk=000051905.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051905

0 1
 O    2.441600      0.3550000     -0.1831000    
 O   -4.433600       1.729700      1.5200000E-02
 O    1.303800      -1.623200     -3.3900000E-02
 N   0.1918000      0.4406000     -0.1007000    
 C   -1.159000      9.8600000E-02 -3.0500000E-02
 C   -2.132700       1.097400     -4.4000000E-02
 C   -1.535700      -1.241800      5.4800000E-02
 C   -3.483300      0.7556000      2.8000001E-02
 C   -2.886000      -1.583400      0.1268000    
 C   -3.859800     -0.5849000      0.1133000    
 C    1.302200     -0.4000000     -9.9200003E-02
 C    3.677000     -0.3698000     -0.1916000    
 C    4.804100      0.6042000     -0.2867000    
 C    5.769500      0.7218000      0.6317000    
 H   -1.847100       2.144800     -0.1099000    
 H  -0.8393000      -2.068700      7.0400000E-02
 H   0.3948000       1.435600     -0.1609000    
 H   -3.180600      -2.626800      0.1933000    
 H   -4.908400     -0.8644000      0.1699000    
 H    3.748600     -0.9753000      0.7196000    
 H    3.702400      -1.032200      -1.064300    
 H    4.835000       1.249100      -1.160900    
 H   -5.311300       1.314400      7.2099999E-02
 H    6.563700       1.449100      0.5034000    
 H    5.786000      0.1013000       1.520800    


%chk=000051905-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051905

0 1
O 2.428244 0.383330 1.018601
O -4.413580 1.688614 0.421922
O 1.505776 -1.472644 -0.110529
N 0.211873 0.387513 0.604584
C -1.105913 0.048312 0.193015
C -2.128317 0.986293 0.482098
C -1.413893 -1.165928 -0.478716
C -3.455687 0.709543 0.100110
C -2.751552 -1.414603 -0.848808
C -3.784974 -0.493408 -0.570017
C 1.371095 -0.350913 0.439233
C 3.778728 -0.255712 0.911062
C 4.424153 0.049689 -0.416614
C 5.571612 0.759667 -0.548943
H -1.914962 1.928640 0.998245
H -0.621597 -1.883218 -0.697380
H 0.340000 1.282114 1.082779
H -2.993858 -2.349078 -1.366562
H -4.819629 -0.705969 -0.866530
H 4.342910 0.174116 1.753236
H 3.647810 -1.345247 1.046215
H 3.917257 -0.362661 -1.299107
H -5.312075 1.411780 0.114968
H 6.025885 0.938146 -1.529754
H 6.094393 1.178323 0.320490


